SMILES for Metallo-beta-lactamase type 2

CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CI)CC1 |r,wU:9.8,wD:12.12,(-3.85,-4,;-5.39,-4,;-6.16,-5.33,;-4.62,-5.33,;-6.16,-2.67,;-5.39,-1.33,;-6.16,-0,;-3.85,-1.33,;-3.08,,;-1.54,,;-.77,1.33,;.77,1.33,;1.54,,;3.08,,;3.85,-1.33,;.77,-1.33,;-.77,-1.33,)|

BDBM262155

CC(C)(C)OC(=O)NCc1ccc(cn1)B1OC(C)(C)C(C)(C)O1

BDBM367842

CC(C)(C)OC(=O)\N=C(/N)Nc1ccccc1B(O)O

BDBM262925

CC(C)(C)c1ccc(N2CCC(N)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262309

CC(C)(C)c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360961

CC(C)(CN)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM361054

CC(C)(CN)NS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360931

CC(C)(N)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367907

CC(C)(N)CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262773

CC(C)(O)C1CCC(N1)c1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262771

CC(C)(O)C1CN(C1)c1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262484

CC(C)(O)C1CN(Cc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)C1

BDBM50488254

CC(C)CC(=O)N[C@H](C)C(=O)S[C@@H](C)Cc1ccc(cc1)-c1ccccc1 |r|

BDBM262315

CC(C)Cc1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM50322609

CC(C)OP(=O)(OC(C)C)C(S)c1ccccc1

BDBM50322605

CC(C)OP(=O)(OC(C)C)c1ccccc1CS

BDBM50322603

CC(C)OP(=O)(OC(C)C)c1ccccc1S

BDBM262761

CC(C)[C@@H](N)CN1CCC(CC1)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |r|

BDBM262762

CC(C)[C@H](N)CN1CCC(CC1)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |r|

BDBM50092842

CC(C)[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r|

BDBM262636

CC(C)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262304

CC(C)c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262257

CC(C)n1nccc1-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262371

CC(C1CCN(CC1)c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O)N1CCOCC1

BDBM262492

CC(CC(O)=O)NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262835

CC(CCCN)N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:10.13,wD:7.6,(-3.33,.36,;-3.33,1.9,;-4.67,2.67,;-6,1.9,;-7.34,2.67,;-8.67,1.9,;-2,2.67,;-.67,1.9,;-.67,.36,;.67,-.41,;2,.36,;2,1.9,;.67,2.67,;3.33,-.41,;3.33,-1.95,;4.67,-2.72,;6,-1.95,;6,-.41,;4.67,.36,;4.67,1.9,;3.42,2.8,;3.9,4.26,;5.44,4.26,;5.91,2.8,;7.34,.36,;8.67,1.13,;8.67,-.41,;8.11,1.69,;7.34,-2.72,;8.67,-1.95,;7.34,-4.26,;8.67,-3.49,)|

BDBM360960

CC(CN)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360895

CC(CN1CCOCC1)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262872

CC(CO)(CO)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262515

CC(N(C)Cc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O)C(O)=O

BDBM530918

CC(N)C1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM360953

CC(N)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368082

CC(N)CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262153

CC(N1CCOCC1)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262506

CC(NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O)C(O)=O

BDBM262501

CC(NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O)c1nn[nH]n1

BDBM262830

CC(N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F)C1CCNCC1 |r,wU:6.9,wD:3.2,(-4,,;-4,1.54,;-2.67,2.31,;-1.33,1.54,;-1.33,,;,-.77,;1.33,,;1.33,1.54,;,2.31,;2.67,-.77,;2.67,-2.31,;4,-3.08,;5.33,-2.31,;5.33,-.77,;4,,;4,1.54,;2.76,2.45,;3.23,3.91,;4.77,3.91,;5.25,2.45,;6.67,,;8,.77,;8,-.77,;7.44,1.33,;6.67,-3.08,;8,-2.31,;6.67,-4.62,;8,-3.85,;-5.33,2.31,;-5.33,3.85,;-6.67,4.62,;-8,3.85,;-8,2.31,;-6.67,1.54,)|

BDBM262392

CC(O)C1CCN(CC1)c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262499

CC(O)C1CCN(Cc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)C1

BDBM262494

CC1(C)CCN(Cc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)C1

BDBM531041

CC1(C)CN(CCN1CCO)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM50140671

CC1(C)S[C@@H]2[C@@H](CO)C(=O)N2[C@H]1C(O)=O

BDBM50140667

CC1(C)S[C@@H]2[C@@H](CS)C(=O)N2[C@H]1C(O)=O

BDBM50140670

CC1(C)S[C@@H]2[C@@H](S)C(=O)N2[C@H]1C(O)=O

BDBM50140672

CC1(C)S[C@@H]2[C@H](CO)C(=O)N2[C@H]1C(O)=O

BDBM50140673

CC1(C)S[C@@H]2[C@H](CS)C(=O)N2[C@H]1C(O)=O

BDBM50140665

CC1(C)S[C@@H]2[C@H](S)C(=O)N2[C@H]1C(O)=O

BDBM50099196

CC1(C)[C@@H](N2[C@@H](C(C\C=C\C=O)C2=O)S1(=O)=O)C(O)=O

BDBM50021954

CC1(C)[C@@H](N2[C@@H](CC2=O)S1(=O)=O)C(O)=O |r|

BDBM50076672

CC1(C)[C@@H](N2[C@@H]([C@@H](CO)C2=O)S1(=O)=O)C(O)=O

BDBM50140668

CC1(C)[C@@H](N2[C@@H]([C@@H](CS)C2=O)S1(=O)=O)C(O)=O

BDBM50140669

CC1(C)[C@@H](N2[C@@H]([C@@H](S)C2=O)S1(=O)=O)C(O)=O

BDBM50076678

CC1(C)[C@@H](N2[C@@H]([C@H](CO)C2=O)S1(=O)=O)C(O)=O

BDBM50140666

CC1(C)[C@@H](N2[C@@H]([C@H](CS)C2=O)S1(=O)=O)C(O)=O

BDBM50099194

CC1(C)[C@@H](N2[C@@H]([C@H](Cc3cn(CC(N)Cc4ccc(O)cc4)nn3)C2=O)S1(=O)=O)C(O)=O

BDBM50099185

CC1(C)[C@@H](N2[C@@H]([C@H](Cc3cn(CC4CCCN4)nn3)C2=O)S1(=O)=O)C(O)=O

BDBM50099193

CC1(C)[C@@H](N2[C@@H]([C@H](Cc3cn(nn3)-c3ccc(F)cc3)C2=O)S1(=O)=O)C(O)=O

BDBM50099184

CC1(C)[C@@H](N2[C@@H]([C@H](Cc3cn(nn3)-c3ccc(N)cc3)C2=O)S1(=O)=O)C(O)=O

BDBM50099190

CC1(C)[C@@H](N2[C@@H]([C@H](Cc3cn(nn3)-c3ccc(O)cc3)C2=O)S1(=O)=O)C(O)=O

BDBM50099192

CC1(C)[C@@H](N2[C@@H]([C@H](Cc3cn(nn3)-c3ccccc3)C2=O)S1(=O)=O)C(O)=O

BDBM50099191

CC1(C)[C@@H](N2[C@H](C(C\C=C\C#N)C2=O)S1(=O)=O)C(O)=O

BDBM360901

CC1(CCCNC1)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM531006

CC1(CN)CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM360945

CC1(CN)CN(C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM361340

CC1(CNC1)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361100

CC1(CNC1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262801

CC1(O)CCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM530927

CC1(O)CCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262800

CC1(O)CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM530939

CC1(O)CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262782

CC1(O)CN(C1)c1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262226

CC1(SC(=O)NC1=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262224

CC1C(=O)Nc2ccc(cc12)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM530871

CC1CC(CN)CCN1c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM531044

CC1CN(CCN1CCO)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM50488263

CCC(=O)N[C@H](C)C(=O)S[C@@H](C)Cc1ccc(cc1)-c1ccccc1 |r|

BDBM50322608

CCC(=S)P(O)(O)O

BDBM361107

CCC(CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM50322607

CCC(S)P(=O)(OC(C)C)OC(C)C

BDBM360900

CCC1(CCNC1)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM50488272

CCCC(=O)N[C@H](C)C(=O)S[C@@H](C)Cc1ccc(cc1)-c1ccccc1 |r|

BDBM50488293

CCCCC(=O)N[C@H](C)C(=O)S[C@@H](C)Cc1ccc(cc1)-c1ccccc1 |r|

BDBM50488267

CCCCCC(=O)N[C@H](C)C(=O)S[C@@H](C)Cc1ccc(cc1)-c1ccccc1 |r|

BDBM50174306

CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccc(O)cc2)cc1

BDBM50174227

CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2)cc1

BDBM50174181

CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2N)cc1

BDBM50174186

CCCCc1ccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2O)cc1

BDBM50042528

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cc(Cl)cc1Cl |(-5.8,-11.85,;-4.26,-11.87,;-3.45,-10.55,;-1.91,-10.57,;-1.02,-9.31,;-1.5,-7.84,;-.25,-6.94,;1.01,-7.84,;2.47,-7.38,;3.96,-8.12,;2.8,-5.87,;4.28,-5.45,;4.68,-3.96,;.52,-9.31,;1.42,-10.57,;2.96,-10.55,;3.73,-11.88,;5.27,-11.88,;6.03,-10.55,;5.24,-9.22,;3.72,-9.24,;7.57,-10.53,;8.34,-11.88,;9.88,-11.87,;10.63,-10.53,;9.86,-9.19,;8.32,-9.21,;7.77,-7.74,;9.03,-6.84,;8.57,-5.37,;7.04,-5.37,;6.54,-6.83,;-.64,-5.43,;.46,-4.34,;1.87,-4.11,;.04,-2.86,;-1.43,-2.45,;-1.85,-.94,;-2.52,-3.56,;-2.12,-5.04,;-3.26,-6.11,)|

BDBM50042574

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cc(Cl)ccc1Cl

BDBM50042564

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1

BDBM50042568

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1Cl

BDBM50042548

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cccc(Cl)c1

BDBM50042531

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cccc(Cl)c1Cl

BDBM50042579

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1

BDBM50042562

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1-c1ccccc1

BDBM50042532

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C

BDBM50042540

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C(F)(F)F

BDBM50042561

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1Cl

BDBM50042557

CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1[N+]([O-])=O

BDBM50042576

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cc(Cl)cc1Cl |(-2.96,-14.32,;-1.41,-14.32,;-.64,-13.02,;.92,-13.03,;1.82,-11.79,;1.36,-10.32,;2.6,-9.41,;3.84,-10.32,;5.31,-9.83,;5.63,-8.33,;6.79,-10.57,;3.37,-11.79,;4.27,-13.03,;5.81,-13.02,;6.57,-14.35,;8.11,-14.34,;8.86,-13.02,;8.09,-11.69,;6.56,-11.7,;10.41,-13,;11.18,-14.34,;12.71,-14.32,;13.48,-13,;12.69,-11.64,;11.16,-11.67,;10.63,-10.21,;11.87,-9.31,;11.4,-7.85,;9.86,-7.83,;9.38,-9.3,;2.2,-7.88,;3.31,-6.78,;4.76,-6.54,;2.91,-5.28,;1.4,-4.86,;.98,-3.34,;.29,-5.99,;.69,-7.47,;-.47,-8.57,)|

BDBM50042565

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cccc1Cl |(-6.39,-5.83,;-4.86,-5.84,;-4.08,-4.52,;-2.54,-4.53,;-1.61,-3.29,;-2.1,-1.82,;-.85,-.9,;.39,-1.82,;1.86,-1.35,;2.18,.16,;3.35,-2.08,;-.08,-3.29,;.81,-4.53,;2.36,-4.52,;3.12,-5.86,;4.66,-5.84,;5.42,-4.52,;4.63,-3.2,;3.1,-3.2,;6.96,-4.5,;7.72,-5.84,;9.27,-5.84,;10.01,-4.5,;9.25,-3.16,;7.71,-3.16,;7.18,-1.7,;8.42,-.81,;7.94,.66,;6.41,.66,;5.94,-.81,;-1.26,.59,;-2.73,.98,;-3.86,-.07,;-3.12,2.44,;-2.04,3.56,;-.56,3.14,;-.16,1.68,;1.25,1.9,)|

BDBM50042577

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cc(Cl)ccc1Cl

BDBM50042556

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1

BDBM50042543

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1Cl

BDBM50042535

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cccc(Cl)c1

BDBM50042542

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cccc(Cl)c1Cl

BDBM50042555

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1

BDBM50042558

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1-c1ccccc1

BDBM50042569

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C

BDBM50042578

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C(F)(F)F

BDBM50042559

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1Cl

BDBM50042544

CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1[N+]([O-])=O

BDBM368024

CCCS(=O)(=O)c1ccc(C2=CCC(N)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |t:10|

BDBM262408

CCCc1ccc(-c2ccc(cc2)C2CCNCC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM73278

CCCc1ccc(cc1)C(=O)CCC(O)=O

BDBM262450

CCCc1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM368102

CCCn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262158

CCN(CC)C(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262500

CCN1CCC(CC1)NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262322

CCNC(=O)N1CCC(CC1)c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262261

CCOC(=O)CCn1cc(cn1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367870

CCOC(=O)N1CC(C1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367859

CCOC(=O)N1CCC(CC1)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262321

CCOC(=O)N1CCC(CC1)c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367897

CCOC(=O)Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM361274

CCOC(=O)c1sc(N)nc1-c1cccc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC(CN)CN

BDBM262545

CCOCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM427428

CC[C@@H](CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361108

CC[C@H](CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM262493

CC[C@H](CO)NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |r|

BDBM50174307

CCc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccc(O)cc1

BDBM50174228

CCc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1

BDBM50174309

CCc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1N

BDBM50174189

CCc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1O

BDBM368096

CCn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368097

CCn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262899

CCn1c(N)nc2cc(ccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM360880

CN(C)C(=O)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360973

CN(C)C(=O)c1ccccc1-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530982

CN(C)C1(C)CN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262772

CN(C)C1(C)CN(C1)c1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262503

CN(C)C1CCC(CC1)NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |(7.44,-4.98,;6.1,-5.75,;6.1,-7.29,;4.77,-4.98,;4.77,-3.44,;3.44,-2.67,;2.1,-3.44,;2.1,-4.98,;3.44,-5.75,;.77,-2.67,;.77,-1.13,;-.56,-.36,;-1.9,-1.13,;-3.23,-.36,;-3.23,1.18,;-1.9,1.95,;-.56,1.18,;-4.56,1.95,;-5.9,1.18,;-7.23,1.95,;-7.23,3.49,;-5.9,4.26,;-4.56,3.49,;-3.23,4.26,;-1.77,3.79,;-.86,5.03,;-1.77,6.28,;-3.23,5.8,;-5.9,5.8,;-6.3,7.29,;-4.81,6.89,;-7.44,5.8,)|

BDBM262774

CN(C)C1CCN(C1)c1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360870

CN(C)C1CCN(CC1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360883

CN(C)C1CN(C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360860

CN(C)CC(F)(F)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM530968

CN(C)CC1(O)CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262367

CN(C)CCC1CCN(CC1)c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262504

CN(C)CCCCNCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262516

CN(C)CCCN(C)Cc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360896

CN(C)CCCN(C)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262496

CN(C)CCCNCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262181

CN(C)CCCOc1ccc(cn1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262238

CN(C)CCNC(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM360866

CN(C)CCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262787

CN(C)CCNc1nc2c(cccc2s1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM368139

CN(C)CCS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262475

CN(C)Cc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360994

CN(C)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262210

CN(C)S(=O)(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM530936

CN(C)[C@@H]1CCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262495

CN(C)[C@@H]1CCN(Cc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)C1 |r|

BDBM530935

CN(C)[C@H]1CCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262931

CN(C)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262359

CN(C)c1ccc(cn1)-c1ccnc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262380

CN(C1CCCCC1)c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360908

CN(C1CCCNC1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360898

CN(C1CCN(C)C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262228

CN(C1CCOCC1)C(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM360885

CN(C1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360951

CN(C1CN(C)C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM361098

CN(C1CNC1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360949

CN(C1CNC1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262512

CN(CC(O)=O)Cc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262509

CN(CCC(O)=O)Cc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262792

CN(CCCCN)c1nc2c(cccc2s1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM427613

CN(CCN)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361292

CN(CCN)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(C2=NNNN2)c1S(N)(=O)=O |t:25|

BDBM262776

CN(CCN1CCCC1)c1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM531004

CN(CCO)CCN(C)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM262483

CN(CCO)Cc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360944

CN(CCc1ccncc1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360965

CN(C[C@@H]1CCCN1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM262377

CN(Cc1ccccc1)c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM361087

CN([C@H]1CCNC1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM360909

CN([C@H]1CCNC1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM262206

CN(c1ncc(cn1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O)S(C)(=O)=O

BDBM262518

CN1C2CCC1CC(C2)NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |TLB:0:1:7.6.8:3.4|

BDBM262479

CN1CC(C1)NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM361099

CN1CC(C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367865

CN1CC(C1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360882

CN1CC2(C1)CCN(C2)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262480

CN1CCC(C1)NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360897

CN1CCC(C1)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360946

CN1CCC(CNS(=O)(=O)c2ccc(-c3cccc4sc(N)nc34)c(-c3nnn[nH]3)c2S(N)(=O)=O)C1

BDBM262497

CN1CCC(NCc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)C1=O

BDBM262779

CN1CCC2(CCN(C2)c2ccc(cn2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)C1

BDBM262216

CN1CCC=C(C1)c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O |c:4|

BDBM360862

CN1CCCC(C1)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM50271891

CN1CCN(CC1)NC(=O)CN1C(=O)S\C(=C/c2c(Cl)ccc(Cl)c2Cl)C1=O

BDBM50271826

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2c(C)cccc2C)C1=O

BDBM50247639

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2c(Cl)ccc(Cl)c2Cl)C1=O

BDBM50271963

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2c(Cl)cccc2Cl)C1=O

BDBM50271801

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2c(F)ccc(F)c2F)C1=O

BDBM50271800

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2c(F)cccc2Cl)C1=O

BDBM50271825

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2c(F)cccc2F)C1=O

BDBM50271875

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2cc(Cl)ccc2Cl)C1=O

BDBM50271902

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O

BDBM50271843

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2ccc(C)cc2)C1=O

BDBM50271845

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2ccc(F)cc2)C1=O

BDBM50271867

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2cccc(Cl)c2Cl)C1=O

BDBM50271823

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2ccccc2)C1=O

BDBM50271935

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2ccccc2Br)C1=O

BDBM50271924

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2ccccc2Cl)C1=O

BDBM50271921

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2ccccc2F)C1=O

BDBM50271937

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2ccccc2I)C1=O

BDBM50271961

CN1CCN(CC1)NC(=O)CN1C(=S)S\C(=C/c2csc3ccccc23)C1=O

BDBM360871

CN1CCN(CC1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262264

CN1CCN(CC1)c1cc(ccn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262276

CN1CCN(CC1)c1ncc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM530933

CN1CCN(CC1=O)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262477

CN1CCN(Cc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)CC1

BDBM360861

CN1CCOC(CNS(=O)(=O)c2ccc(-c3cccc4sc(N)nc34)c(-c3nnn[nH]3)c2S(N)(=O)=O)C1

BDBM530983

CN1CCOC2(CN(C2)c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)S(=O)(=O)N[C@@H]2CCNC2)C1 |r|

BDBM361075

CN1CC[C@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM50191387

CN1CCn2cc(\C=C3/[C@H]4SC=C(N4C3=O)C([O-])=O)nc2C1 |c:11|

BDBM262514

CN1[C@H]2CC[C@@H]1CC(C2)NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |r,TLB:0:1:7.8.6:3.4|

BDBM262519

CNC(=O)CNCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360867

CNC(=O)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262162

CNC(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367952

CNC(=O)c1ccc(cn1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM368068

CNC(=O)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262962

CNC1CC(C1)N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-8.55,6.09,;-8.55,4.55,;-7.22,3.78,;-5.73,4.18,;-5.33,2.7,;-6.82,2.3,;-4,1.93,;-2.51,2.32,;-2.11,.84,;-3.6,.44,;-.78,.07,;.55,.84,;1.89,.07,;1.89,-1.47,;.55,-2.24,;-.78,-1.47,;3.22,-2.24,;3.22,-3.78,;4.55,-4.55,;5.89,-3.78,;5.89,-2.24,;4.55,-1.47,;4.55,.07,;3.31,.97,;3.78,2.44,;5.32,2.44,;5.8,.97,;7.22,-1.47,;8.55,-2.24,;8.55,-.7,;7.22,.07,;7.22,-4.55,;8.55,-3.78,;7.22,-6.09,;8.55,-5.32,)|

BDBM262946

CNC1CC(C1)N1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-8.95,6.32,;-8.95,4.78,;-7.61,4.01,;-6.12,4.41,;-5.73,2.92,;-7.21,2.52,;-4.39,2.15,;-3.06,2.92,;-1.72,2.15,;-1.72,.61,;-3.06,-.16,;-4.39,.61,;-.39,-.16,;.94,.61,;2.28,-.16,;2.28,-1.7,;.94,-2.47,;-.39,-1.7,;3.61,-2.47,;3.61,-4.01,;4.94,-4.78,;6.28,-4.01,;6.28,-2.47,;4.94,-1.7,;4.94,-.16,;3.7,.75,;4.17,2.21,;5.71,2.21,;6.19,.75,;7.61,-1.7,;8.95,-.93,;8.95,-2.47,;7.61,-.16,;7.61,-4.78,;8.95,-4.01,;7.61,-6.32,;8.95,-5.55,)|

BDBM262873

CNC1CCc2c1cccc2-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262507

CNCC(C)NCc1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM530942

CNCC1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM427151

CNCCCN(C)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360937

CNCCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(=O)(=O)NC

BDBM262784

CNCCN(C)c1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262821

CNCCN1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM360875

CNCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262482

CNCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM427052

CNS(=O)(=O)c1ccc(-c2cccc3cn[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360995

CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262208

CNS(=O)(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM361086

CNc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM361085

CNc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361310

CNc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM361123

CNc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361138

CNc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM368138

CNc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CCNCC1

BDBM367903

CNc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM367919

CNc1ncc(cn1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM531032

COC(=O)C1CCN(CCN1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM368069

COC(=O)CNC(=O)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262179

COC(=O)N1CCC(CC1)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM360972

COC(=O)[C@H]1C[C@H](CN1)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM50099189

COC(=O)\C=C\CC1[C@@H]2N([C@@H](C(O)=O)C(C)(C)S2(=O)=O)C1=O

BDBM50099186

COC(=O)\C=C\CC1[C@H]2N([C@@H](C(O)=O)C(C)(C)S2(=O)=O)C1=O

BDBM262403

COC(=O)c1ccc(-c2nn[nH]n2)c(c1)S(N)(=O)=O

BDBM262330

COC(=O)c1ccc(cc1)-c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM368010

COC(=O)c1cccc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM368154

COC(=O)c1cccc(c1NCCN)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM368065

COC(=O)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM530984

COC1(CN(C)C)CN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530889

COC1(CO)CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM530887

COC1(CO)CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H](C)CN |r|

BDBM262202

COC1CCN(CC1)C(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM360929

COCCNCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360868

COCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262659

COCc1cc(CCc2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)C(F)(F)F)cnc1N

BDBM50099187

CON(C)C(=O)\C=C\CC1[C@@H]2N([C@@H](C(O)=O)C(C)(C)S2=O)C1=O

BDBM262239

CONC(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM360952

CO[C@H]1CNC[C@@H]1NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM50488294

COc1cc(OC)c(C(=O)N[C@H](C)C(=O)S[C@@H](C)Cc2ccc(cc2)-c2ccccc2)c(OC)c1 |r|

BDBM262283

COc1cc(ccn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM367982

COc1cc(cnc1N)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM367977

COc1ccc(-c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)S(=O)(=O)CCN)c2[nH]c(nc12)C(F)(F)F

BDBM50488282

COc1ccc(CC(=O)N[C@H](C)C(=O)S[C@@H](C)Cc2ccc(cc2)-c2ccccc2)cc1 |r|

BDBM427138

COc1ccc(CN(Cc2ccc(OC)cc2)S(=C)(=C)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)N[C@H](CO)CNC(=O)OCc2ccccc2)cc1 |r|

BDBM262183

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(Br)ccc(-c3ccc(cc3)C3CN(C3)C(=O)OC(C)(C)C)c2-c2nnn(Cc3ccc(OC)cc3)n2)cc1

BDBM367887

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)CCCNC(=O)OC(C)(C)C)cc1

BDBM367892

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)cc1 |r|

BDBM367893

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)OCc2ccccc2)cc1 |r|

BDBM367890

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)C[C@@H](CO)NC(=O)OC(C)(C)C)cc1 |r|

BDBM367888

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)C[C@H](C)NC(=O)OC(C)(C)C)cc1 |r|

BDBM367894

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)C[C@H](CNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)cc1 |r|

BDBM367891

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)C[C@H](CO)NC(=O)OC(C)(C)C)cc1 |r|

BDBM360928

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC(CNC(=O)OC(C)(C)C)CNC(=O)OC(C)(C)C)cc1

BDBM360925

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)cc1 |r|

BDBM360917

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@@H](CO)NC(=O)OC(C)(C)C)cc1 |r|

BDBM360919

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@@H](O)CNC(=O)OC(C)(C)C)cc1

BDBM360920

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@@H]2CN(CCN2C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc1

BDBM427141

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@H](CNC(=O)OC(C)(C)C)NC(=O)OCc2ccccc2)cc1 |r|

BDBM360922

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@H](CNC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)cc1

BDBM360924

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@H](CO)NC(=O)OCc2ccccc2)cc1 |r|

BDBM360918

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@H](O)CNC(=O)OC(C)(C)C)cc1

BDBM360921

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)NC[C@H]2CN(CCN2C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc1

BDBM360923

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)N[C@@H](CO)CNC(=O)OC(C)(C)C)cc1

BDBM360912

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)N[C@@H]2CCN(C2)C(=O)OC(C)(C)C)cc1

BDBM360926

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)N[C@@H]2CN(C[C@@H]2NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc1

BDBM360927

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)N[C@H](CO)CNC(=O)OCc2ccccc2)cc1

BDBM360916

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)N[C@H]2CCN(C2)C(=O)OC(C)(C)C)cc1

BDBM427137

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)N[C@H]2CN(C[C@@H]2NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc1 |r|

BDBM367889

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2c(ccc(I)c2-c2nnn(Cc3ccc(OC)cc3)n2)S(=O)(=O)[C@H]2C[C@@H](CO)N(C2)C(=O)OCc2ccccc2)cc1 |r|

BDBM50191381

COc1ccc(CN2CCc3sc(\C=C4/[C@H]5SC=C(N5C4=O)C([O-])=O)cc3C2)cc1 |c:17|

BDBM368044

COc1ccc(Cc2cc3c(cccc3[nH]2)-c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)S(=O)(=O)C2CNC2)cc1

BDBM368042

COc1ccc(Cc2cc3c(cccc3n2C)-c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)S(=O)(=O)C2CNC2)cc1

BDBM367676

COc1ccc(Cn2cc(CN(Cc3ccccn3)Cc3ccccn3)nn2)cc1

BDBM367683

COc1ccc(Cn2cc(CN(Cc3ccccn3)Cc3ccccn3)nn2)cc1Br

BDBM367682

COc1ccc(Cn2cc(CN(Cc3ccccn3)Cc3ccccn3)nn2)cc1[N+]([O-])=O

BDBM262090

COc1ccc(Cn2nnnc2-c2c(Br)cccc2S(N)(=O)=O)cc1 |(1.62,-.28,;.6,-1.44,;-.91,-1.14,;-1.92,-2.3,;-3.43,-2,;-3.93,-.54,;-5.44,-.24,;-5.94,1.22,;-5.08,2.52,;-5.99,3.76,;-7.45,3.29,;-7.45,1.75,;-8.79,.98,;-10.12,1.75,;-10.12,3.29,;-11.46,.98,;-11.46,-.56,;-10.12,-1.33,;-8.79,-.56,;-7.45,-1.33,;-6.12,-.56,;-8.22,-2.67,;-6.68,-2.67,;-2.91,.62,;-1.4,.32,)|

BDBM50271915

COc1ccc(\C=C(/S)C(O)=O)cc1

BDBM50271914

COc1ccc(\C=C2/SC(=S)N(CC(=O)NN3CCN(C)CC3)C2=O)cc1

BDBM50271904

COc1ccc(\C=C2/SC(=S)N(CC(O)=O)C2=O)cc1

BDBM262401

COc1ccc(c(c1)-c1nn[nH]n1)S(N)(=O)=O

BDBM262157

COc1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM50484377

COc1ccc(cc1)-n1c(c(-c2ccccc2)c2c(Cl)ncnc12)-c1ccccc1

BDBM367677

COc1ccc(cc1)-n1cc(CN(Cc2ccccn2)Cc2ccccn2)nn1

BDBM50488287

COc1ccc(cc1)C(=O)N[C@H](C)C(=O)S[C@@H](C)Cc1ccc(cc1)-c1ccccc1 |r|

BDBM262229

COc1ccc(cn1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM50157691

COc1ccc2c(c1)sc1nc(\C=C3/[C@H]4SC=C(N4C3=O)C(=O)O[Na])cn21 |r,c:17|

BDBM262286

COc1ccc2cc(cnc2n1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM50488292

COc1cccc(c1)C(=O)N[C@H](C)C(=O)S[C@@H](C)Cc1ccc(cc1)-c1ccccc1 |r|

BDBM262405

COc1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262188

COc1cccc(n1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM50322613

COc1ccccc1C(=S)P(O)(O)O

BDBM360878

COc1ccnc(CNS(=O)(=O)c2ccc(-c3cccc4sc(N)nc34)c(-c3nnn[nH]3)c2S(N)(=O)=O)n1

BDBM262191

COc1cncc(n1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262427

COc1nc2cc(Cl)c(cc2[nH]1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262242

COc1ncc(cn1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM360889

CS(=O)(=O)C1CCN(C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262778

CS(=O)(=O)C1CN(C1)c1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM530985

CS(=O)(=O)CCN1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM262205

CS(=O)(=O)CCn1cc(cn1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367868

CS(=O)(=O)N1CC(C1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367858

CS(=O)(=O)N1CCC(CC1)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262320

CS(=O)(=O)N1CCC(CC1)c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262317

CS(=O)(=O)NC1CCC(CC1)c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O |(-6.15,-3.35,;-5.06,-2.26,;-5.46,-.77,;-5.06,-3.8,;-3.57,-2.66,;-2.09,-2.26,;-1.69,-.77,;-.2,-.37,;.89,-1.46,;.49,-2.95,;-1,-3.35,;2.38,-1.06,;3.47,-2.15,;4.95,-1.75,;5.35,-.27,;4.26,.82,;2.78,.42,;1.69,1.51,;1.69,3.05,;.22,3.53,;-.68,2.28,;.22,1.04,;4.66,2.31,;5.06,3.8,;3.57,3.4,;6.15,2.71,)|

BDBM262418

CS(=O)(=O)Nc1ccc(cc1)-c1ccc(Br)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262422

CS(=O)(=O)Nc1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM360980

CS(=O)(=O)Nc1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262233

CS(=O)(=O)Nc1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262354

CS(=O)(=O)Nc1ccc(cc1)-c1ccnc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262237

CS(=O)(=O)Nc1cccc(c1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262350

CS(=O)(=O)Nc1cccc(c1)-c1ccnc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367896

CS(=O)(=O)Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM360999

CS(=O)(=O)Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N1CCNCC1

BDBM368050

CS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368054

CS(=O)(=O)c1ccc(-c2ccc(NS(=O)(=O)C3CC3)cc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368049

CS(=O)(=O)c1ccc(-c2ccc(cc2)C2CCNCC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368004

CS(=O)(=O)c1ccc(-c2cccc3cn[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368053

CS(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368052

CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368051

CS(=O)(=O)c1ccc(-c2cnc3ccccn23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368022

CS(=O)(=O)c1ccc([C@@H]2CC[C@H](N)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r,wU:11.11,8.7,(6.2,-2.79,;4.72,-2.39,;4.32,-3.87,;5.11,-.9,;3.23,-1.99,;2.09,-3.06,;.6,-2.66,;.2,-1.18,;-1.29,-.78,;-1.69,.71,;-3.17,1.11,;-4.26,.02,;-5.75,.42,;-3.86,-1.47,;-2.38,-1.87,;1.29,-.09,;.89,1.4,;1.98,2.49,;1.28,3.86,;-.24,3.62,;-.48,2.1,;2.78,-.49,;4.11,.28,;5.6,.68,;4.11,1.82,;2.78,1.05,)|

BDBM368023

CS(=O)(=O)c1ccc([C@H]2CC[C@H](N)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r,wU:11.11,wD:8.7,(6.2,-2.79,;4.72,-2.39,;4.32,-3.87,;5.11,-.9,;3.23,-1.99,;2.09,-3.06,;.6,-2.66,;.2,-1.18,;-1.29,-.78,;-1.69,.71,;-3.17,1.11,;-4.26,.02,;-5.75,.42,;-3.86,-1.47,;-2.38,-1.87,;1.29,-.09,;.89,1.4,;1.98,2.49,;1.28,3.86,;-.24,3.62,;-.48,2.1,;2.78,-.49,;4.11,.28,;5.6,.68,;4.11,1.82,;2.78,1.05,)|

BDBM262167

CS(=O)(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM574714

CS(=O)(=O)c1ccc(cc1)-c1ccn(c1C([O-])=O)S(N)(=O)=O

BDBM262209

CS(=O)(=O)c1ccc(cn1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262426

CS(=O)(=O)c1nc2cc(Cl)c(cc2[nH]1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM368048

CS(=O)c1ccc(-c2ccc(cc2)C2CCNCC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM50092976

CSCC[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O |r|

BDBM368047

CSc1ccc(-c2ccc(cc2)C2CCNCC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM361342

C[C@@H](CCN)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361110

C[C@@H](CCN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361240

C[C@@H](CN)NS(=O)(=O)c1ccc(-c2cc(F)cc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361237

C[C@@H](CN)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361029

C[C@@H](CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361232

C[C@@H](CN)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(=O)=O |r|

BDBM427553

C[C@@H](CN)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361241

C[C@@H](CN)NS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530886

C[C@@H](CN)NS(=O)(=O)c1ccc(N2CCC(O)(CN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368093

C[C@@H](CN)S(=O)(=O)c1ccc(-c2cccc3n(C)c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368091

C[C@@H](CN)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368099

C[C@@H](CN)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM50488277

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)C(C)C |r|

BDBM50488269

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)CCC(=O)c1ccccc1 |r|

BDBM50488258

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)CCCC(O)=O |r|

BDBM50488280

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)CCc1ccccc1 |r|

BDBM50488281

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)CNC(=O)c1ccccc1 |r|

BDBM50488279

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)COc1ccccc1 |r|

BDBM50488278

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)CSCC(O)=O |r|

BDBM50488284

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)Cc1ccc(O)cc1 |r|

BDBM50488283

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)Cc1ccc(cc1)N(C)C |r|

BDBM50488257

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)Cc1cccc2ccccc12 |r|

BDBM50488268

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)Cc1ccccc1 |r|

BDBM50488270

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)Cc1ccccc1Cc1ccccc1 |r|

BDBM50488261

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)Cc1cccnc1 |r|

BDBM50488275

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)OCC=C |r|

BDBM50488295

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)\C=C\c1ccccc1 |r|

BDBM50488288

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)c1ccc2ccccc2c1 |r|

BDBM50488291

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)c1cccc(c1)N(C)C |r|

BDBM50488276

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(=O)c1ccccc1 |r|

BDBM50488266

C[C@@H](Cc1ccc(cc1)-c1ccccc1)SC(=O)[C@@H](C)NC(C)=O |r|

BDBM50488265

C[C@@H](Cc1ccc2oc3ccccc3c2c1)SC(=O)[C@@H](C)NC(=O)OCC=C |r|

BDBM50488273

C[C@@H](Cc1ccc2oc3ccccc3c2c1)SC(=O)[C@@H](C)NC(=O)c1ccccc1 |r|

BDBM50488259

C[C@@H](Cc1ccc2oc3ccccc3c2c1)SC(=O)[C@@H](C)NC(C)=O |r|

BDBM50488274

C[C@@H](Cc1ccccc1)SC(=O)[C@@H](C)NC(=O)c1ccccc1 |r|

BDBM361323

C[C@@H](N)CNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361266

C[C@@H](N)CNS(=O)(=O)c1ccc(-c2ccc3nccn3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361028

C[C@@H](N)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361233

C[C@@H](N)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(=O)=O |r|

BDBM427554

C[C@@H](N)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361265

C[C@@H](N)CNS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368080

C[C@@H](N)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368161

C[C@@H](N)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)C(O)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368172

C[C@@H](N)CS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368088

C[C@@H](N)CS(=O)(=O)c1ccc(-c2cccc3n(C)c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368081

C[C@@H](N)CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361116

C[C@@H](N)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262505

C[C@@H](O)[C@H](NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O)C(O)=O |r|

BDBM367678

C[C@@H]([NH3+])C(=O)N[C@H](C)C(=O)NCCc1ccc(NC(=O)CN(Cc2ccccn2)Cc2ccccn2)cc1 |r|

BDBM262180

C[C@@H]1NC(=O)O[C@H]1c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |r|

BDBM361341

C[C@H](CCN)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361109

C[C@H](CCN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361239

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cc(F)cc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361236

C[C@H](CN)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361161

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cccc(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361226

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361030

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361080

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]nnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361238

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cccc3n(C)c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361227

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cccn3ccnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361055

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361303

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cccnc2NCCN)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361160

C[C@H](CN)NS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361064

C[C@H](CN)NS(=O)(=O)c1ccc(-c2cncc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531053

C[C@H](CN)NS(=O)(=O)c1ccc(N2CCC(CCN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530904

C[C@H](CN)NS(=O)(=O)c1ccc(N2CCC(CN)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530914

C[C@H](CN)NS(=O)(=O)c1ccc(N2CCC(CO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530875

C[C@H](CN)NS(=O)(=O)c1ccc(N2CC[C@@H](CN)[C@@H](F)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530872

C[C@H](CN)NS(=O)(=O)c1ccc(N2CC[C@@H](N)[C@@H](F)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368092

C[C@H](CN)S(=O)(=O)c1ccc(-c2cccc3n(C)c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368090

C[C@H](CN)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368098

C[C@H](CN)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM21642

C[C@H](CS)C(=O)N1CCC[C@H]1C(O)=O

BDBM361051

C[C@H](N)CC(=O)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361322

C[C@H](N)CNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361027

C[C@H](N)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM360971

C[C@H](N)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM361264

C[C@H](N)CNS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM367905

C[C@H](N)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368107

C[C@H](N)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)C(O)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368168

C[C@H](N)CS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368089

C[C@H](N)CS(=O)(=O)c1ccc(-c2cccc3n(C)c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM367906

C[C@H](N)CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361284

C[C@H](N)Cc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361285

C[C@H](N)Cc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(N)(=O)=O |r|

BDBM361115

C[C@H](N)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262399

C[C@H](O)c1nc(no1)-c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O |r|

BDBM50488286

C[C@H]([C@@H]([C@H](Cc1ccccc1)C(O)=O)C(O)=O)c1ccccc1 |r|

BDBM262339

C[C@H]1NC(=O)OC1c1ccc(cc1)-c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O |r|

BDBM360985

C[C@H]1NC(=O)O[C@H]1c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262174

C[C@H]1NC(=O)O[C@H]1c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |r|

BDBM50157692

C[C@]1(Cn2ccnn2)[C@@H](N2[C@@H](CC2=O)S1(=O)=O)C(=O)O[Na] |r|

BDBM50053173

C[C@]1(Cn2ccnn2)[C@@H](N2[C@@H](CC2=O)S1(=O)=O)C(O)=O |r|

BDBM50076680

C[C@]1(\C=C\C#N)[C@@H](N2[C@@H](CC2=O)S1(=O)=O)C([O-])=O

BDBM530940

C[N+](C)(C)CCCCNc1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361235

C[N+](C)(C)CCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(=O)=O

BDBM427556

C[N+](C)(C)CCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262824

C[N+](C)(C)CCN1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM361234

C[N+](C)(C)CCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(=O)=O

BDBM427555

C[N+](C)(C)CCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262592

C[N+]1(C)CCC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM361009

C[N+]1(C)CC[C@@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[n-]n2)c1S(N)(=O)=O

BDBM262667

C[N+]1(C)CCc2c(C1)cccc2-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM361092

C[N+]1(CCN)CC[C@@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM427409

C[N]1(C)CC(C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |(5.22,-2.8,;3.73,-2.4,;4.82,-1.31,;2.4,-3.17,;1.63,-1.84,;2.96,-1.07,;.14,-1.44,;-.26,.05,;.14,1.54,;1.23,.45,;-1.8,.05,;-2.57,-1.28,;-4.11,-1.28,;-4.88,.05,;-6.42,.05,;-7.19,1.38,;-8.73,1.38,;-9.5,.05,;-8.73,-1.28,;-9.2,-2.75,;-7.96,-3.65,;-7.96,-5.19,;-6.71,-2.75,;-7.19,-1.28,;-4.11,1.38,;-4.88,2.72,;-6.38,3.04,;-6.55,4.57,;-5.14,5.19,;-4.11,4.05,;-2.57,1.38,;-1.8,2.72,;-.26,2.72,;-2.57,4.05,;-1.03,4.05,)|

BDBM361088

C[N]1(C)CC(C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |(5.7,-2.78,;4.21,-2.38,;5.15,-1.16,;2.88,-3.15,;2.11,-1.82,;3.44,-1.05,;.62,-1.42,;.23,.07,;.62,1.56,;1.71,.47,;-1.31,.07,;-2.08,-1.26,;-3.62,-1.26,;-4.39,.07,;-5.93,.07,;-6.7,1.4,;-8.24,1.4,;-9.01,.07,;-8.24,-1.26,;-8.72,-2.73,;-7.47,-3.63,;-7.47,-5.17,;-6.23,-2.73,;-6.7,-1.26,;-3.62,1.4,;-4.39,2.74,;-5.93,2.9,;-6.25,4.4,;-4.91,5.17,;-3.77,4.14,;-2.08,1.4,;-1.31,2.74,;.23,2.74,;-.54,4.07,;-2.08,4.07,)|

BDBM262583

C[N]1(C)CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F |(-8.02,-1.75,;-6.48,-1.75,;-7.25,-.41,;-5.39,-.66,;-4.3,-1.75,;-5.39,-2.84,;-2.76,-1.75,;-1.99,-.41,;-.45,-.41,;.32,-1.75,;-.45,-3.08,;-1.99,-3.08,;1.86,-1.75,;2.63,-3.08,;4.17,-3.08,;4.99,-1.75,;4.17,-.41,;2.63,-.41,;1.86,.92,;.32,.92,;-.16,2.38,;1.09,3.29,;2.33,2.38,;4.94,.92,;6.43,.52,;3.85,2.01,;5.34,2.41,;6.53,-1.75,;8.07,-1.75,;6.53,-3.29,;6.53,-.21,)|

BDBM262752

C[N]1(C)CCC(Cc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |(5.73,-5.19,;4.96,-3.85,;6.5,-3.85,;3.42,-3.85,;2.65,-2.52,;3.42,-1.18,;2.65,.15,;1.11,.15,;.34,-1.18,;-1.2,-1.18,;-1.97,.15,;-3.51,.15,;-4.28,1.48,;-5.82,1.48,;-6.59,.15,;-5.82,-1.18,;-4.28,-1.18,;-8.13,.15,;-9.22,1.24,;-10.31,.15,;-9.22,-.94,;-1.2,1.48,;-1.97,2.82,;-1.49,4.28,;-2.74,5.19,;-3.98,4.28,;-3.51,2.82,;.34,1.48,;1.11,2.82,;2.45,2.05,;1.88,4.15,;-.22,3.59,;4.96,-1.18,;5.73,-2.52,)|

BDBM361076

C[N]1(C)CC[C@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361091

C[N]1(CCN)CC[C@@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM427412

C[N]1(CCN)CC[C@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM50488260

C\C=C\C(=O)N[C@H](C)C(=O)S[C@@H](C)Cc1ccc(cc1)-c1ccccc1 |r|

BDBM262400

Cc1cc(-c2nnn[nH]2)c(cc1C)S(N)(=O)=O

BDBM426626

Cc1cc(Br)c2c(CP(O)(O)=O)cc(=O)oc2c1

BDBM426620

Cc1cc(C)c2c(CP(O)(O)=O)cc(=O)oc2c1

BDBM262502

Cc1cc(CNCc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)n[nH]1

BDBM262704

Cc1cc(N)ncc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262720

Cc1cc(N)ncc1Cc1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367912

Cc1cc(cnc1C#N)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361311

Cc1cc(cnc1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H](O)CN |r|

BDBM361320

Cc1cc(cnc1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM367985

Cc1cc(cnc1N)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262263

Cc1cc2nccn2cc1-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM367828

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)C2CNC2)c2nc(N)[nH]c12

BDBM367845

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)C2CNC2)c2nc(N)sc12

BDBM367846

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)C2CNC2)c2sc(N)nc12

BDBM367836

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)CCN)c2nc(N)[nH]c12

BDBM361172

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)NCCN)c2nc(N)[nH]c12

BDBM361128

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)N[C@@H]2CCNC2)c2nc(N)[nH]c12 |r|

BDBM368000

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)[C@@H]2CCNC2)c2nc(N)sc12 |r|

BDBM368001

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)[C@H]2CCNC2)c2nc(N)sc12 |r|

BDBM368006

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(C)(=O)=O)c2nc(N)sc12

BDBM360850

Cc1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(N)(=O)=O)c2nc(N)sc12

BDBM262715

Cc1ccc(-c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)C(F)(F)F)c2[nH]c(N)nc12

BDBM262410

Cc1ccc(-c2ccc(cc2)C2CCNCC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262311

Cc1ccc(Cc2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)cc1

BDBM262327

Cc1ccc(Oc2cccc(c2-c2nn[nH]n2)S(N)(=O)=O)cc1

BDBM50271824

Cc1ccc(\C=C(/S)C(O)=O)cc1

BDBM50271838

Cc1ccc(\C=C2/SC(=S)N(CC(O)=O)C2=O)cc1

BDBM262635

Cc1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262440

Cc1ccc(cc1)-c1cc(cc(c1-c1nn[nH]n1)S(N)(=O)=O)-c1ccc(O)nc1

BDBM262444

Cc1ccc(cc1)-c1cc(cc(c1-c1nn[nH]n1)S(N)(=O)=O)-c1ccc(cc1)C(N)=O

BDBM262438

Cc1ccc(cc1)-c1cc(cc(c1-c1nn[nH]n1)S(N)(=O)=O)-c1ccc2C(=O)NCc2c1

BDBM262442

Cc1ccc(cc1)-c1cc(cc(c1-c1nn[nH]n1)S(N)(=O)=O)-c1ccc2CNCc2c1

BDBM262443

Cc1ccc(cc1)-c1cc(cc(c1-c1nn[nH]n1)S(N)(=O)=O)-c1cccc(c1)C(N)=O

BDBM262441

Cc1ccc(cc1)-c1cc(cc(c1-c1nn[nH]n1)S(N)(=O)=O)-c1cccnc1

BDBM262439

Cc1ccc(cc1)-c1cc(cc(c1-c1nn[nH]n1)S(N)(=O)=O)-c1cnn(C)c1

BDBM262415

Cc1ccc(cc1)-c1ccc(Br)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262411

Cc1ccc(cc1)-c1ccc(Cl)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262416

Cc1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM574713

Cc1ccc(cc1)-c1ccn(c1C([O-])=O)S(N)(=O)=O

BDBM262338

Cc1ccc(cc1)-c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM50484372

Cc1ccc(cc1)-n1c(c(-c2ccccc2)c2c(Cl)ncnc12)-c1ccccc1

BDBM50484374

Cc1ccc(cc1)-n1c(c(-c2ccccc2)c2c(N\N=C\c3ccccc3)ncnc12)-c1ccccc1

BDBM50484375

Cc1ccc(cc1)-n1c(c(-c2ccccc2)c2c1ncn1c2n[nH]c1=S)-c1ccccc1

BDBM50484373

Cc1ccc(cc1)-n1cc(-c2ccccc2)c2c(Cl)ncnc12

BDBM50484532

Cc1ccc(cc1)C(=O)c1ccc(cc1)C(=O)NNC(N)=S

BDBM262447

Cc1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262546

Cc1ccc(nc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM50157688

Cc1ccc2c(c1)sc1nc(\C=C3/[C@H]4SC=C(N4C3=O)C(=O)O[Na])cn21 |r,c:16|

BDBM367935

Cc1ccc2cccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2n1

BDBM50271889

Cc1cccc(C)c1\C=C(/S)C(O)=O

BDBM50271879

Cc1cccc(C)c1\C=C1/SC(=S)N(CC(O)=O)C1=O

BDBM262306

Cc1cccc(Cc2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)c1

BDBM262298

Cc1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM50157687

Cc1cccc2sc3nc(\C=C4/[C@H]5SC=C(N5C4=O)C(=O)O[Na])cn3c12 |r,c:14|

BDBM262473

Cc1ccccc1-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262358

Cc1ccccc1-c1ccnc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262303

Cc1ccccc1Cc1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM50174308

Cc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccc(O)cc1

BDBM50174229

Cc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1

BDBM50174310

Cc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1N

BDBM50174191

Cc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1O

BDBM262287

Cc1cccn2c(cnc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262894

Cc1ccncc1-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262465

Cc1ccncc1-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262396

Cc1cnc(cn1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262185

Cc1csc(n1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262802

Cc1n[nH]c2CCN(Cc12)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM367975

Cc1n[nH]c2cc(F)c(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM367939

Cc1n[nH]c2ccc(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262508

Cc1nc(CNCc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)no1

BDBM262230

Cc1nc(F)ccc1-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262702

Cc1nc(N)ccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM367983

Cc1nc(N)ccc1-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262719

Cc1nc(N)ccc1Cc1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM368144

Cc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262452

Cc1nc2ccccc2n1Cc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262154

Cc1nc2ccccc2n1Cc1ccc(cc1)B1OC(C)(C)C(C)(C)O1

BDBM262253

Cc1nccn1-c1nc(cs1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367946

Cc1nnc2ccc(cn12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262262

Cc1nnc2ccc(cn12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262259

Cc1sccc1-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM50174194

Clc1cccc(NC(=O)CSc2nnc([nH]2)-c2ccccc2)c1

BDBM50174195

Clc1ccccc1NC(=O)CSc1nnc([nH]1)-c1ccccc1

BDBM262707

Cn1c(N)[nH+]cc1-c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM361010

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[n-]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CC[N+](C)(C)C1

BDBM367835

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368008

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCCN

BDBM368176

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C[C@@H](O)CN |r|

BDBM368175

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C[C@H](O)CN |r|

BDBM361001

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N1CCNCC1

BDBM361026

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCCN

BDBM360854

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM361151

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H](O)CN |r|

BDBM361145

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM361007

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361006

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM368005

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(C)(=O)=O

BDBM360849

Cn1c(N)nc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(N)(=O)=O

BDBM367832

Cn1c(N)nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c12

BDBM574733

Cn1c([NH3+])nc2c(cccc12)-c1ccn(c1C(O)=O)S(N)(=O)=O

BDBM574743

Cn1cc(cn1)-c1ccn(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM574715

Cn1cc(cn1)-c1ccn(c1C([O-])=O)S(N)(=O)=O

BDBM367966

Cn1cc2cc(ccc2n1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262275

Cn1cc2cc(ccc2n1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM367967

Cn1cc2ccc(cc2n1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262248

Cn1ccc(n1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262189

Cn1ccnc1-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262768

Cn1ccnc1CN1CCC(CC1)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262481

Cn1cnc(CNCc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)c1

BDBM360864

Cn1cnc(CNS(=O)(=O)c2ccc(-c3cccc4sc(N)nc34)c(-c3nnn[nH]3)c2S(N)(=O)=O)n1

BDBM367916

Cn1cnc2cc(cnc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262194

Cn1cncc1-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262378

Cn1cncc1C1CCN(CC1)c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262767

Cn1cncc1CN1CCC(CC1)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262511

Cn1cncc1C[C@@H](NCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O)C(O)=O |r|

BDBM368078

Cn1nc(N)c2c(cccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368079

Cn1nc(N)c2c(cccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM361124

Cn1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)N[C@@H]3CCNC3)c2n1 |r|

BDBM367936

Cn1ncc2c(cccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM367973

Cn1ncc2cc(ccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262219

Cn1ncc2cc(ccc12)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367943

Cn1ncc2cccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c12

BDBM262200

Cn1nccc1-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM361136

Cn1nnc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM367932

Cn1nnc2ccc(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM360978

Cn1nnc2ccc(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262218

Cn1nnc2ccc(cc12)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM50157694

Fc1ccc2c(c1)sc1nc(\C=C3/[C@H]4SC=C(N4C3=O)C(=O)O[Na])cn21 |r,c:16|

BDBM262750

NC(=N)N1CC(C1)c1ccc(cc1)-c1ccc(CC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262582

NC(=N)N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262972

NC(=N)N1CCC(CC1)[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:12.16,wD:9.9,(6,-6.16,;6,-4.62,;7.34,-3.85,;4.67,-3.85,;3.33,-4.62,;2,-3.85,;2,-2.31,;3.33,-1.54,;4.67,-2.31,;.67,-1.54,;.67,,;-.67,.77,;-2,,;-2,-1.54,;-.67,-2.31,;-3.33,.77,;-4.67,,;-6,.77,;-6,2.31,;-4.67,3.08,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.54,5.1,;.37,3.85,;-.54,2.6,;-4.67,4.62,;-6.21,4.62,;-4.67,6.16,;-3.13,4.62,;-7.34,3.08,;-8.67,2.31,;-7.34,4.62,;-7.34,1.54,)|

BDBM262751

NC(=N)N1CCC(Cc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1

BDBM262586

NC(=N)N1CCC(N)(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262969

NC(=N)N1CCC2(CC1)CCN(CC2)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262973

NC(=N)N1CCC2(CCC(CC2)c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)C(F)(F)F)CC1

BDBM262594

NC(=N)N1Cc2ccc(cc2C1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262620

NC(=N)NC1CCC(CCc2ccc(-c3ccc(cc3)C3CCN(CC3)C(N)=N)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |(12.38,-1.18,;10.84,-1.18,;10.07,.15,;10.07,-2.52,;8.64,-2.52,;7.87,-3.85,;6.33,-3.85,;5.56,-2.52,;4.22,-2.52,;3.45,-1.18,;1.91,-1.18,;1.14,-2.52,;-.4,-2.52,;-1.17,-1.18,;-2.71,-1.18,;-3.48,.15,;-5.02,.15,;-5.79,-1.18,;-5.02,-2.52,;-3.48,-2.52,;-7.1,-1.18,;-7.87,.15,;-9.41,.15,;-10.18,-1.18,;-9.41,-2.52,;-7.87,-2.52,;-11.61,-1.18,;-12.38,-2.52,;-12.38,.15,;-.4,.15,;-1.17,1.48,;-2.71,1.48,;-3.19,2.95,;-1.94,3.85,;-.7,2.95,;1.14,.15,;1.91,1.48,;3.39,1.08,;2.68,2.82,;.57,2.25,;6.33,-1.18,;7.87,-1.18,)|

BDBM262671

NC(=N)NC1CCC(CCc2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)C(F)(F)F)CC1 |(-8,2.56,;-6.67,1.79,;-6.67,.25,;-5.33,2.56,;-4,1.79,;-2.67,2.56,;-1.33,1.79,;-1.33,.25,;,-.52,;1.33,.25,;2.67,-.52,;2.67,-2.06,;4,-2.83,;5.38,-2.09,;5.33,-.52,;4,.25,;4,1.79,;2.76,2.7,;3.23,4.16,;4.77,4.16,;5.25,2.7,;6.67,.25,;8,1.02,;7.44,-1.08,;5.9,1.59,;6.72,-2.86,;8.05,-3.63,;5.95,-4.19,;7.86,-1.83,;-2.67,-.52,;-4,.25,)|

BDBM262971

NC(=N)NC1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262595

NC(=N)NC1Cc2ccc(cc2C1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262651

NC(=N)NC[C@H]1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:5.4,(-6.75,-11.21,;-6.35,-9.72,;-7.44,-8.63,;-4.86,-9.33,;-4.46,-7.84,;-2.98,-7.44,;-2.58,-5.95,;-1.09,-5.55,;,-6.64,;-.4,-8.13,;-1.89,-8.53,;1.49,-6.24,;2.58,-7.33,;4.06,-6.93,;4.52,-5.43,;3.37,-4.36,;1.89,-4.76,;.8,-3.67,;-.74,-3.67,;-1.22,-2.2,;.03,-1.3,;1.27,-2.2,;3.77,-2.87,;5.11,-2.1,;3.77,-1.33,;5.11,-3.64,;6,-5.03,;7.49,-4.63,;6.4,-6.52,;6.08,-3.5,)|

BDBM262650

NC(=N)NC[C@H]1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:5.4,(-6.75,-11.21,;-6.35,-9.72,;-7.44,-8.64,;-4.86,-9.33,;-4.46,-7.84,;-2.98,-7.44,;-2.58,-5.95,;-1.09,-5.55,;,-6.64,;-.4,-8.13,;-1.89,-8.53,;1.49,-6.24,;2.58,-7.33,;4.06,-6.93,;4.52,-5.43,;3.37,-4.36,;1.89,-4.76,;.8,-3.67,;-.74,-3.67,;-1.22,-2.2,;.03,-1.3,;1.27,-2.2,;3.77,-2.87,;5.11,-2.1,;3.77,-1.33,;5.11,-3.64,;6,-5.03,;7.49,-4.64,;6.4,-6.52,;6.08,-3.5,)|

BDBM262741

NC(=N)NCc1ccc(cc1)-c1ccc(CC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262588

NC(=N)NCc1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262970

NC(=N)N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:4.3,wD:7.10,(6,-4.23,;4.67,-3.47,;4.67,-1.93,;3.33,-4.23,;2,-3.47,;.67,-4.23,;-.67,-3.47,;-.67,-1.93,;.67,-1.15,;2,-1.93,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-2,.38,;-.67,1.15,;-.67,2.69,;.8,3.17,;1.7,1.93,;.8,.68,;-3.33,2.69,;-4.87,2.69,;-3.33,4.23,;-1.79,2.69,;-6,1.15,;-7.34,.39,;-6,2.69,;-6,-.38,)|

BDBM368034

NC(=N)Nc1ccccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361035

NC(=N)c1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(N)(=O)=O

BDBM262630

NC(=N)c1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM367875

NC(=N)c1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262809

NC(=O)C1CCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM530960

NC(=O)C1CCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262803

NC(=O)C1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM530962

NC(=O)C1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531033

NC(=O)C1CCN(CCN1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262485

NC(=O)C1CCN(Cc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)C1

BDBM262510

NC(=O)C1CN(Cc2ccc(cc2)-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)C1

BDBM262686

NC(=O)CCc1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262597

NC(=O)CCc1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM367863

NC(=O)CN1CC(C1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262756

NC(=O)CN1CCC(Cc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1

BDBM262488

NC(=O)CNCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262596

NC(=O)Cc1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262451

NC(=O)Cc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM367869

NC(=O)N1CC(C1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367862

NC(=O)N1CCC(CC1)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM531064

NC(=O)[C@@H]1CN(CCN1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531065

NC(=O)[C@H]1CN(CCN1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262675

NC(=O)c1cc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)C(F)(F)F)c2[nH]1

BDBM367852

NC(=O)c1ccc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)C2CNC2)c2nc(N)sc12

BDBM367880

NC(=O)c1ccc(c(N)n1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM360981

NC(=O)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262165

NC(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM574729

NC(=O)c1ccc(cc1)-c1ccn(c1C(O)=O)S(N)(=O)=O

BDBM262332

NC(=O)c1ccc(cc1)-c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262674

NC(=O)c1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262436

NC(=O)c1ccc2cc(ccc2n1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262232

NC(=O)c1cccc(c1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262352

NC(=O)c1cccc(c1)-c1ccnc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367872

NC(=O)c1cn2cccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2n1

BDBM361314

NC(=O)c1csc(Nc2cccc(c2)-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)N[C@@H]2CCNC2)n1 |r|

BDBM368067

NC(=O)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361114

NC(=O)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361135

NC(=O)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM262429

NC(=O)c1nccc2cc(ccc12)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM50484535

NC(=S)NNC(=O)c1ccc(Cc2ccccc2)cc1

BDBM50484536

NC(=S)NNC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)[N+]([O-])=O

BDBM50484531

NC(=S)NNC(=O)c1ccc(cc1)C(=O)c1cccc(c1)[N+]([O-])=O

BDBM50484533

NC(=S)NNC(=O)c1ccc(cc1)C(=O)c1ccccc1

BDBM50484534

NC(=S)NNC(=O)c1ccc(cc1)C(=O)c1ccccc1Cl

BDBM360893

NC(CCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O)C(F)(F)F

BDBM360968

NC(CCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O)C(F)F

BDBM360967

NC(CF)CCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360962

NC(CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O)C(F)F

BDBM367909

NC(CO)CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM50484530

NC(S)=NNC(=O)c1ccccc1

BDBM262875

NC1(CC(O)C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-5.51,.34,;-4.74,1.67,;-3.97,3,;-5.31,3.77,;-5.71,5.26,;-6.08,2.44,;-3.41,.9,;-2.08,1.67,;-.74,.9,;-.74,-.64,;-2.08,-1.41,;-3.41,-.64,;.59,-1.41,;.59,-2.95,;1.92,-3.72,;3.26,-2.95,;3.26,-1.41,;1.92,-.64,;1.92,.9,;3.17,1.8,;2.69,3.27,;1.15,3.27,;.68,1.8,;4.59,-.64,;5.92,-1.41,;4.99,.85,;6.08,-.24,;4.59,-3.72,;4.59,-5.26,;5.92,-2.95,;5.92,-4.49,)|

BDBM262913

NC1(CC1)C1CCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262876

NC1(CCCC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262585

NC1(CCN(CC1)C=N)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262584

NC1(CCNCC1)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262431

NC1(CCNCC1)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262877

NC1(CCOC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262953

NC1(CN2CC(C2)c2ccc(cc2)-c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)C(F)(F)F)CC1

BDBM262819

NC1(CN2CCC(CC2)c2ccc(cc2)-c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)C(F)(F)F)CC1

BDBM262981

NC1(CN2CCC3(CCC(CC3)c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)C(F)(F)F)CC2)CC1

BDBM262977

NC1(CNC2CCC(CC2)c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)C(F)(F)F)CC1 |(-6.88,2.24,;-6.88,.7,;-5.39,.3,;-4.3,1.39,;-2.81,.99,;-2.04,2.33,;-.55,1.9,;.93,2.33,;.16,.99,;-1.33,1.42,;2.41,1.93,;3.5,3.02,;4.99,2.62,;5.44,1.12,;4.3,.04,;2.81,.44,;1.72,-.65,;2.2,-2.11,;.95,-3.02,;-.29,-2.11,;.18,-.65,;4.7,-1.44,;3.93,-2.78,;6.03,-2.21,;6.03,-.67,;6.93,.72,;8.42,.32,;7.01,-.82,;7.33,2.21,;-8.36,1.1,;-7.97,-.39,)|

BDBM530952

NC1(CO)CCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262658

NC1=NCC(CN1)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |t:1|

BDBM360957

NC1C2CN(CC12)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262954

NC1CC(C1)N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-8.55,5.32,;-7.22,4.55,;-5.73,4.95,;-5.33,3.47,;-6.82,3.07,;-4,2.7,;-2.51,3.09,;-2.11,1.61,;-3.6,1.21,;-.78,.84,;.55,1.61,;1.89,.84,;1.89,-.7,;.55,-1.47,;-.78,-.7,;3.22,-1.47,;3.22,-3.01,;4.55,-3.78,;5.89,-3.01,;5.89,-1.47,;4.55,-.7,;4.55,.84,;3.31,1.74,;3.78,3.21,;5.32,3.21,;5.8,1.74,;7.22,-.7,;8.55,-1.47,;8.55,.07,;7.22,.84,;7.22,-3.78,;8.55,-3.01,;7.22,-5.32,;8.55,-4.55,)|

BDBM262937

NC1CC(C1)N1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-8.95,5.55,;-7.61,4.78,;-6.12,5.18,;-5.73,3.69,;-7.21,3.29,;-4.39,2.92,;-3.06,3.69,;-1.72,2.92,;-1.72,1.38,;-3.06,.61,;-4.39,1.38,;-.39,.61,;.94,1.38,;2.28,.61,;2.28,-.93,;.94,-1.7,;-.39,-.93,;3.61,-1.7,;3.61,-3.24,;4.94,-4.01,;6.28,-3.24,;6.28,-1.7,;4.94,-.93,;4.94,.61,;3.7,1.52,;4.17,2.98,;5.71,2.98,;6.19,1.52,;7.61,-.93,;8.95,-.16,;8.95,-1.7,;7.61,.61,;7.61,-4.01,;8.95,-3.24,;7.61,-5.55,;8.95,-4.78,)|

BDBM262841

NC1CC(C1)N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:9.13,wD:6.6,(-7.61,.04,;-6.28,.81,;-5.88,2.29,;-4.39,1.9,;-4.79,.41,;-3.06,2.67,;-1.72,1.9,;-1.72,.36,;-.39,-.41,;.94,.36,;.94,1.9,;-.39,2.67,;2.28,-.41,;2.28,-1.95,;3.61,-2.72,;4.94,-1.95,;4.94,-.41,;3.61,.36,;3.61,1.9,;2.36,2.8,;2.84,4.26,;4.38,4.26,;4.86,2.8,;6.28,.36,;7.61,1.13,;7.61,-.41,;7.05,1.69,;6.28,-2.72,;7.61,-1.95,;6.28,-4.26,;7.61,-3.49,)|

BDBM360939

NC1CC2OC1CCC2NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262955

NC1CCC(C1)N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262933

NC1CCC(C1)N1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262838

NC1CCC(C1)N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:10.14,wD:7.7,(-7.96,1.13,;-6.42,1.13,;-5.51,-.12,;-4.05,.36,;-4.05,1.9,;-5.51,2.37,;-2.71,2.67,;-1.38,1.9,;-1.38,.36,;-.05,-.41,;1.29,.36,;1.29,1.9,;-.05,2.67,;2.62,-.41,;2.62,-1.95,;3.96,-2.72,;5.29,-1.95,;5.29,-.41,;3.96,.36,;3.96,1.9,;2.71,2.8,;3.19,4.26,;4.73,4.26,;5.2,2.8,;6.62,.36,;7.96,1.13,;7.96,-.41,;7.39,1.69,;6.62,-2.72,;7.96,-1.95,;6.62,-4.26,;7.96,-3.49,)|

BDBM262956

NC1CCC(CC1)N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-8.95,5.55,;-7.61,4.78,;-6.28,5.55,;-4.94,4.78,;-4.94,3.24,;-6.28,2.47,;-7.61,3.24,;-3.61,2.47,;-2.12,2.87,;-1.72,1.38,;-3.21,.98,;-.39,.61,;.94,1.38,;2.28,.61,;2.28,-.93,;.94,-1.7,;-.39,-.93,;3.61,-1.7,;3.61,-3.24,;4.94,-4.01,;6.28,-3.24,;6.28,-1.7,;4.94,-.93,;4.94,.61,;3.7,1.52,;4.17,2.98,;5.71,2.98,;6.19,1.52,;7.61,-.93,;8.95,-1.7,;8.95,-.16,;7.61,.61,;7.61,-4.01,;8.95,-3.24,;7.61,-5.55,;8.95,-4.78,)|

BDBM262941

NC1CCC(CC1)N1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-9.34,5.78,;-8,5,;-8,3.46,;-6.67,2.69,;-5.33,3.46,;-5.33,5,;-6.67,5.77,;-4,2.69,;-2.67,3.46,;-1.33,2.69,;-1.33,1.15,;-2.67,.38,;-4,1.15,;,.38,;1.33,1.15,;2.67,.38,;2.67,-1.16,;1.33,-1.93,;,-1.16,;4,-1.93,;4,-3.47,;5.33,-4.24,;6.67,-3.47,;6.67,-1.93,;5.33,-1.16,;5.33,.38,;4.09,1.29,;4.56,2.75,;6.1,2.75,;6.58,1.29,;8,-1.16,;9.34,-.39,;9.34,-1.93,;8,.38,;8,-4.24,;9.34,-3.47,;8,-5.78,;9.34,-5.01,)|

BDBM262848

NC1CCC(CC1)N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:11.15,wD:8.8,(-8,-.41,;-6.67,.36,;-6.67,1.9,;-5.33,2.67,;-4,1.9,;-4,.36,;-5.33,-.41,;-2.67,2.67,;-1.33,1.9,;-1.33,.36,;,-.41,;1.33,.36,;1.33,1.9,;,2.67,;2.67,-.41,;2.67,-1.95,;4,-2.72,;5.33,-1.95,;5.33,-.41,;4,.36,;4,1.9,;2.76,2.8,;3.23,4.26,;4.77,4.26,;5.25,2.8,;6.67,.36,;8,1.13,;8,-.41,;6.67,1.9,;6.67,-2.72,;8,-1.95,;6.67,-4.26,;8,-3.49,)|

BDBM262837

NC1CCC(CC1)N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:11.15,wD:8.8,(-8,-.41,;-6.67,.36,;-6.67,1.9,;-5.33,2.67,;-4,1.9,;-4,.36,;-5.33,-.41,;-2.67,2.67,;-1.33,1.9,;-1.33,.36,;,-.41,;1.33,.36,;1.33,1.9,;,2.67,;2.67,-.41,;2.67,-1.95,;4,-2.72,;5.33,-1.95,;5.33,-.41,;4,.36,;4,1.9,;2.76,2.8,;3.23,4.26,;4.77,4.26,;5.25,2.8,;6.67,.36,;8,1.13,;8,-.41,;7.44,1.69,;6.67,-2.72,;8,-1.95,;6.67,-4.26,;8,-3.49,)|

BDBM262607

NC1CCC(CC1)c1ccc(-c2ccc(cc2)C2CCNCC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |(9.24,-1.85,;7.7,-1.85,;6.93,-3.19,;5.39,-3.19,;4.62,-1.85,;5.39,-.52,;6.93,-.52,;3.08,-1.85,;2.31,-3.19,;.77,-3.19,;,-1.85,;-1.54,-1.85,;-2.31,-.52,;-3.85,-.52,;-4.62,-1.85,;-3.85,-3.19,;-2.31,-3.19,;-6.16,-1.85,;-6.93,-.52,;-8.47,-.52,;-9.24,-1.85,;-8.47,-3.19,;-6.93,-3.19,;.77,-.52,;,.82,;-1.54,.82,;-2.02,2.28,;-.77,3.19,;.48,2.28,;2.31,-.52,;3.08,.82,;4.22,.15,;3.85,2.15,;1.75,1.59,)|

BDBM262986

NC1CCC(CC1)c1ccc(CC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O |(-6.93,-.52,;-5.39,-.52,;-4.62,.82,;-3.08,.82,;-2.31,-.52,;-3.08,-1.85,;-4.62,-1.85,;-.77,-.52,;,-1.85,;1.54,-1.85,;2.31,-.52,;3.85,-.52,;4.62,-1.85,;6.16,-1.85,;6.93,-3.19,;6.16,-4.52,;4.62,-4.52,;3.85,-3.19,;1.54,.82,;,.82,;-.77,2.15,;-.29,3.61,;-1.54,4.52,;-2.79,3.61,;-2.31,2.15,;2.31,2.15,;3.85,2.15,;.77,2.15,;3.08,3.48,)|

BDBM262985

NC1CCC(CC1)c1ccc(CCC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O |(-8.08,-1.18,;-6.54,-1.18,;-5.78,.15,;-4.23,.15,;-3.47,-1.18,;-4.23,-2.52,;-5.78,-2.52,;-1.93,-1.18,;-1.15,-2.52,;.38,-2.52,;1.15,-1.18,;2.69,-1.18,;3.47,-2.52,;5,-2.52,;5.78,-3.85,;7.31,-3.85,;8.08,-2.52,;7.31,-1.18,;5.78,-1.18,;.38,.15,;-1.15,.15,;-1.93,1.48,;-1.45,2.95,;-2.69,3.85,;-3.94,2.95,;-3.47,1.48,;1.15,1.48,;2.69,1.48,;-.38,1.48,;1.93,2.82,)|

BDBM368019

NC1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CCNCC1 |(8.53,-2.69,;7.19,-1.92,;5.86,-2.69,;4.53,-1.92,;4.53,-.38,;5.86,.39,;7.19,-.38,;3.19,.39,;3.19,1.93,;1.86,2.7,;.53,1.93,;.53,.39,;1.86,-.38,;1.86,-1.92,;3.11,-2.82,;2.63,-4.29,;1.09,-4.29,;.61,-2.82,;-.81,-.38,;-.04,-1.71,;-2.14,-1.15,;-1.58,.96,;-.81,2.7,;-.04,4.04,;-1.95,1.67,;-2.14,3.47,;-2.14,5.01,;-3.48,5.78,;-4.81,5.01,;-4.81,3.47,;-3.48,2.7,)|

BDBM368016

NC1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CC1CNC1 |(8.24,3.53,;7.47,2.19,;5.93,2.19,;5.16,.86,;5.93,-.47,;7.47,-.47,;8.24,.86,;5.16,-1.81,;3.62,-1.81,;2.85,-3.14,;3.62,-4.47,;5.16,-4.47,;5.93,-3.14,;7.47,-3.14,;8.38,-4.39,;9.84,-3.91,;9.84,-2.37,;8.38,-1.89,;5.93,-5.81,;6.7,-7.14,;4.9,-6.95,;7.27,-5.04,;2.85,-5.81,;2.08,-7.14,;1.52,-5.04,;4.19,-6.58,;4.19,-8.12,;5.28,-9.21,;4.19,-10.3,;3.1,-9.21,)|

BDBM361008

NC1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(N)(=O)=O |(-5.95,-2.93,;-4.46,-2.53,;-4.06,-1.04,;-2.58,-.64,;-1.49,-1.73,;-1.89,-3.22,;-3.37,-3.62,;,-1.33,;1.09,-2.42,;2.58,-2.02,;3.03,-.52,;1.89,.56,;.4,.16,;-.69,1.25,;-2.23,1.25,;-2.71,2.71,;-1.46,3.62,;-.21,2.71,;2.28,2.04,;3.62,2.81,;2.28,3.58,;3.77,1.64,;4.52,-.12,;4.6,1.42,;6,.28,;4.91,-1.61,)|

BDBM262316

NC1CCC(CC1)c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O |(-4.86,-2.88,;-3.37,-2.48,;-2.98,-1,;-1.49,-.6,;-.4,-1.69,;-.8,-3.17,;-2.28,-3.57,;1.09,-1.29,;2.18,-2.38,;3.67,-1.98,;4.06,-.49,;2.98,.6,;1.49,.2,;.4,1.29,;.4,2.83,;-1.07,3.3,;-1.97,2.06,;-1.07,.81,;3.37,2.09,;3.77,3.57,;2.28,3.17,;4.86,2.48,)|

BDBM262688

NC1CCC(CCc2ccc(-c3cccc4sc(N)nc34)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |(-1.36,-5.8,;-.02,-5.03,;-.02,-3.49,;1.31,-2.72,;2.64,-3.49,;3.98,-2.72,;3.98,-1.18,;2.64,-.41,;1.31,-1.18,;-.02,-.41,;-.02,1.13,;-1.36,1.9,;-1.36,3.44,;-2.69,4.21,;-4.02,3.44,;-4.02,1.9,;-5.17,.86,;-4.54,-.54,;-5.31,-1.88,;-3.01,-.38,;-2.69,1.13,;1.31,1.9,;1.31,3.44,;.06,4.34,;.54,5.8,;2.08,5.8,;2.56,4.34,;2.64,1.13,;3.98,1.9,;4.75,.56,;3.21,3.23,;5.31,2.67,;2.64,-5.03,;1.31,-5.8,)|

BDBM262914

NC1CCC2CN(CC2C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262957

NC1CCCC(C1)N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262945

NC1CCCC(C1)N1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262834

NC1CCCC(C1)N[C@H]1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wD:8.8,(-6,-1.95,;-6,-.41,;-7.34,.36,;-7.34,1.9,;-6,2.67,;-4.67,1.9,;-4.67,.36,;-3.33,2.67,;-2,1.9,;-2,.36,;-.67,-.41,;.67,.36,;.67,1.9,;-.67,2.67,;2,-.41,;2,-1.95,;3.33,-2.72,;4.67,-1.95,;4.67,-.41,;3.33,.36,;3.33,1.9,;2.09,2.8,;2.56,4.26,;4.1,4.26,;4.58,2.8,;6,.36,;7.34,1.13,;7.34,-.41,;6.77,1.69,;6,-2.72,;7.34,-1.95,;6,-4.26,;7.34,-3.49,)|

BDBM262908

NC1CCCC11CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262958

NC1CCCC1N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262938

NC1CCCC1N1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM530901

NC1CCCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM530900

NC1CCCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262878

NC1CCCc2ccc(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM531026

NC1CCN(C(=O)C1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262915

NC1CCN(C1)C1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM360992

NC1CCN(CC1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM530941

NC1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262905

NC1CN(C1)C1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM360991

NC1CN(C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262430

NC1CNCCC1(O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM361059

NC1C[C@@H]1NS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262590

NC1Cc2ccc(cc2C1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262983

NC1Cc2cccc(c2C1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM574739

NCC(=O)N1CCC(CC1)c1ccn(c1C(O)=O)S(N)(=O)=O

BDBM361112

NCC(=O)NC1CCCC(=C1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r,c:9|

BDBM361113

NCC(=O)NC1CCC[C@H](C1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r,w:5.4|

BDBM361247

NCC(CN)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361249

NCC(CN)NS(=O)(=O)c1ccc(-c2ccc3nccn3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361278

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc(c2)-c2c[nH]c(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361070

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc(c2)-c2nc[nH]n2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361072

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc(c2)C2N=NC(N)=N2)c(-c2nn[nH]n2)c1S(N)(=O)=O |c:21,24|

BDBM361281

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc(n2)-c2cnc(N)[nH]2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM361228

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361272

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361246

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc3[nH]nnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361273

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc3ccc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361279

NCC(CN)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361229

NCC(CN)NS(=O)(=O)c1ccc(-c2cccn3ccnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361053

NCC(CN)NS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361248

NCC(CN)NS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361280

NCC(CN)NS(=O)(=O)c1ccc(-c2ccnc(c2)-c2cnc(N)[nH]2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM530913

NCC(CN)NS(=O)(=O)c1ccc(N2CCC(CO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262656

NCC(CN)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM361090

NCC(CO)(CO)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361269

NCC(CO)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM361044

NCC(CO)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM360891

NCC(F)(F)CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM361289

NCC(F)(F)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM367910

NCC(O)CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262645

NCC1(N)CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-5.23,-4.36,;-5.63,-2.87,;-4.54,-1.78,;-5.87,-1.01,;-4.14,-.3,;-2.65,.1,;-1.56,-.99,;-1.96,-2.47,;-3.45,-2.87,;-.08,-.59,;1.01,-1.68,;2.5,-1.28,;2.95,.22,;1.81,1.3,;.32,.9,;-.77,1.99,;-2.31,1.99,;-2.78,3.45,;-1.54,4.36,;-.29,3.45,;2.21,2.79,;3.54,3.56,;2.21,4.33,;3.54,2.02,;4.44,.62,;5.93,1.02,;4.84,-.86,;4.52,2.16,)|

BDBM530953

NCC1(O)CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262960

NCC1CCC(CC1)N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-9.61,4.78,;-8.28,5.55,;-6.94,4.78,;-5.61,5.55,;-4.28,4.78,;-4.28,3.24,;-5.61,2.47,;-6.94,3.24,;-2.94,2.47,;-1.46,2.87,;-1.06,1.38,;-2.55,.98,;.28,.61,;1.61,1.38,;2.94,.61,;2.94,-.93,;1.61,-1.7,;.28,-.93,;4.28,-1.7,;4.28,-3.24,;5.61,-4.01,;6.94,-3.24,;6.94,-1.7,;5.61,-.93,;5.61,.61,;4.37,1.52,;4.84,2.98,;6.38,2.98,;6.86,1.52,;8.28,-.93,;9.61,-1.7,;9.61,-.16,;8.28,.61,;8.28,-4.01,;9.61,-3.24,;8.28,-5.55,;9.61,-4.78,)|

BDBM262934

NCC1CCC(CC1)N1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-10,5,;-8.67,5.78,;-7.34,5,;-6,5.78,;-4.67,5,;-4.67,3.47,;-6,2.69,;-7.34,3.47,;-3.33,2.69,;-2,3.46,;-.67,2.69,;-.67,1.15,;-2,.38,;-3.33,1.15,;.67,.38,;2,1.15,;3.33,.38,;3.33,-1.15,;2,-1.93,;.67,-1.15,;4.67,-1.93,;4.67,-3.47,;6,-4.23,;7.34,-3.47,;7.34,-1.93,;6,-1.15,;6,.38,;4.76,1.29,;5.23,2.75,;6.77,2.75,;7.25,1.29,;8.67,-1.15,;10,-.38,;10,-1.93,;8.67,.38,;8.67,-4.23,;10,-3.47,;8.67,-5.78,;10,-5,)|

BDBM262846

NCC1CCC(CC1)N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:12.16,wD:9.9,(-8,-1.95,;-8,-.41,;-6.67,.36,;-6.67,1.9,;-5.33,2.67,;-4,1.9,;-4,.36,;-5.33,-.41,;-2.67,2.67,;-1.33,1.9,;-1.33,.36,;,-.41,;1.33,.36,;1.33,1.9,;,2.67,;2.67,-.41,;2.67,-1.95,;4,-2.72,;5.33,-1.95,;5.33,-.41,;4,.36,;4,1.9,;2.76,2.8,;3.23,4.26,;4.77,4.26,;5.25,2.8,;6.67,.36,;8,1.13,;8,-.41,;7.44,1.69,;6.67,-2.72,;8,-1.95,;6.67,-4.26,;8,-3.49,)|

BDBM360954

NCC1CCCCN1S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM531017

NCC1CCN(C(=O)C1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531003

NCC1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262968

NCC1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM530945

NCC1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531031

NCC1CCN(CCN1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262909

NCC1CN(C1)C1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM360948

NCC1CN(CCO1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262880

NCC1COc2ccc(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM531072

NCC=C1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r,wU:29.32,(-9.62,-2.55,;-8.08,-2.55,;-7.31,-1.22,;-5.77,-1.22,;-5,.11,;-3.46,.11,;-2.7,-1.22,;-3.46,-2.55,;-5,-2.55,;-1.15,-1.22,;-.38,-2.55,;1.15,-2.55,;1.92,-1.22,;1.15,.11,;-.38,.11,;-1.15,1.45,;-.53,2.86,;-1.67,3.89,;-3.01,3.12,;-2.69,1.61,;1.92,1.45,;2.7,2.78,;.59,2.22,;3.41,1.05,;3.46,-1.22,;3.46,-2.76,;3.46,.32,;5,-1.22,;5.77,-2.55,;7.31,-2.55,;8.08,-3.89,;8.08,-1.22,;9.62,-1.22,)|

BDBM574740

NCCC(=O)N1CCC(CC1)c1ccn(c1C(O)=O)S(N)(=O)=O

BDBM531013

NCCC(=O)N1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM262961

NCCC1CCC(CC1)N1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-10.28,5.55,;-8.95,4.78,;-7.61,5.55,;-6.28,4.78,;-4.94,5.55,;-3.61,4.78,;-3.61,3.24,;-4.94,2.47,;-6.28,3.24,;-2.28,2.47,;-.79,2.87,;-.39,1.38,;-1.88,.98,;.94,.61,;2.28,1.38,;3.61,.61,;3.61,-.93,;2.28,-1.7,;.94,-.93,;4.94,-1.7,;4.94,-3.24,;6.28,-4.01,;7.61,-3.24,;7.61,-1.7,;6.28,-.93,;6.28,.61,;5.03,1.52,;5.51,2.98,;7.05,2.98,;7.52,1.52,;8.95,-.93,;10.28,-1.7,;10.28,-.16,;8.95,.61,;8.95,-4.01,;10.28,-3.24,;8.95,-5.55,;10.28,-4.78,)|

BDBM262939

NCCC1CCC(CC1)N1CCC(CC1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-10.67,5.78,;-9.34,5.01,;-8,5.78,;-6.67,5,;-6.67,3.46,;-5.33,2.69,;-4,3.46,;-4,5,;-5.33,5.77,;-2.67,2.69,;-1.33,3.46,;,2.69,;,1.15,;-1.33,.38,;-2.67,1.15,;1.33,.38,;2.67,1.15,;4,.38,;4,-1.16,;2.67,-1.93,;1.33,-1.16,;5.33,-1.93,;5.33,-3.47,;6.67,-4.24,;8,-3.47,;8,-1.93,;6.67,-1.16,;6.67,.38,;5.42,1.29,;5.9,2.75,;7.44,2.75,;7.91,1.29,;9.34,-1.16,;10.67,-.39,;10.67,-1.93,;9.34,.38,;9.34,-4.24,;10.67,-3.47,;9.34,-5.78,;10.67,-5.01,)|

BDBM262840

NCCC1CCC(CC1)N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:13.17,wD:10.10,(-8.67,-2.72,;-7.34,-1.95,;-7.34,-.41,;-6,.36,;-6,1.9,;-4.67,2.67,;-3.33,1.9,;-3.33,.36,;-4.67,-.41,;-2,2.67,;-.67,1.9,;-.67,.36,;.67,-.41,;2,.36,;2,1.9,;.67,2.67,;3.33,-.41,;3.33,-1.95,;4.67,-2.72,;6,-1.95,;6,-.41,;4.67,.36,;4.67,1.9,;3.42,2.8,;3.9,4.26,;5.44,4.26,;5.91,2.8,;7.34,.36,;8.67,1.13,;8.67,-.41,;8.11,1.69,;7.34,-2.72,;8.67,-1.95,;7.34,-4.26,;8.67,-3.49,)|

BDBM531008

NCCC1CCCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM530892

NCCC1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM531055

NCCC1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H](CN)CO |r|

BDBM530884

NCCC1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531056

NCCC1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H](CN)CO |r|

BDBM262902

NCCC1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM531012

NCCC1CN(C1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM531061

NCCCC1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM262791

NCCCCCNc1nc2c(cccc2s1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262964

NCCCCN1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262912

NCCCCN1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM361101

NCCCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262789

NCCCCNc1nc2c(cccc2s1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262963

NCCCN1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262760

NCCCN1CCC(CC1)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262712

NCCCNC(=N)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM361184

NCCCNC(=O)c1cccc(c1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM368188

NCCCNC(=O)c1cccc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM361245

NCCCNS(=O)(=O)c1ccc(-c2cc(F)cc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361339

NCCCNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361025

NCCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361041

NCCCNS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360934

NCCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262790

NCCCNc1nc2c(cccc2s1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM368083

NCCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368167

NCCCS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368007

NCCCS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262882

NCCCc1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262453

NCCCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM367864

NCCN1CC(C1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262959

NCCN1CC(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM427664

NCCN1CCC(C1)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367861

NCCN1CCC(CC1)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262763

NCCN1CCC(CC1)c1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262753

NCCN1CCC(Cc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1

BDBM530919

NCCN1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM530944

NCCN1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531015

NCCN1CCN(CC1=O)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM361111

NCCN1CC[C@@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361343

NCCN1CC[C@H](C1)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361089

NCCN1CC[C@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361293

NCCNC(=O)c1cc(Cl)cc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC1CCNC1

BDBM361290

NCCNC(=O)c1cc(Cl)cc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM427614

NCCNC(=O)c1cc(Cl)cc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361294

NCCNC(=O)c1cc(ccc1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM368150

NCCNC(=O)c1cc(cnc1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM361177

NCCNC(=O)c1cccc(c1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM368101

NCCNC(=O)c1cccc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368191

NCCNC(=O)c1cccc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM361047

NCCNC(=O)c1cccc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM368155

NCCNC(=O)c1ccccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM262975

NCCNC1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-6.92,-3.32,;-5.59,-2.55,;-5.59,-1.01,;-4.26,-.24,;-4.26,1.3,;-3.49,2.63,;-2,2.21,;-.51,2.63,;-1.29,1.3,;-2.77,1.72,;.97,2.23,;2.06,3.32,;3.55,2.92,;4,1.42,;2.86,.35,;1.37,.75,;.28,-.34,;.76,-1.81,;-.49,-2.71,;-1.73,-1.81,;-1.26,-.34,;3.26,-1.14,;2.49,-2.47,;4.59,-1.91,;4.59,-.37,;5.49,1.02,;6.98,.62,;5.57,-.51,;5.89,2.51,)|

BDBM262974

NCCNC1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |(-8.26,.82,;-6.92,1.59,;-5.59,.82,;-4.26,1.59,;-2.92,.82,;-2.15,2.15,;-.66,1.73,;.82,2.15,;.05,.82,;-1.44,1.24,;2.31,1.75,;3.4,2.84,;4.88,2.44,;5.33,.94,;4.19,-.13,;2.7,.26,;1.62,-.82,;1.62,-2.36,;.15,-2.84,;-.75,-1.59,;.15,-.35,;4.59,-1.62,;3.5,-2.71,;6.08,-1.22,;5.68,-2.71,;6.82,.54,;8.31,.14,;6.9,-1,;7.22,2.03,)|

BDBM262976

NCCNC1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM361325

NCCNCCNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361276

NCCNCc1sc(N)nc1-c1cccc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530999

NCCNS(=O)(=O)C1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM531070

NCCNS(=O)(=O)C1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H](CN)CO |r|

BDBM531035

NCCNS(=O)(=O)C1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361023

NCCNS(=O)(=O)c1ccc(-c2cc(F)cc3[nH]c(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM361039

NCCNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361309

NCCNS(=O)(=O)c1ccc(-c2ccc3[nH]c(CN)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361244

NCCNS(=O)(=O)c1ccc(-c2ccc3nccn3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361191

NCCNS(=O)(=O)c1ccc(-c2ccc3ncn(CCN)c3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361319

NCCNS(=O)(=O)c1ccc(-c2ccc3sc(CN)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361175

NCCNS(=O)(=O)c1ccc(-c2cccc(C(=O)NC[C@@H](N)CO)c2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361176

NCCNS(=O)(=O)c1ccc(-c2cccc(C(=O)NC[C@H](N)CO)c2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361296

NCCNS(=O)(=O)c1ccc(-c2cccc(NC(=O)[C@@H](N)CN)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361297

NCCNS(=O)(=O)c1ccc(-c2cccc(NC(=O)[C@H](N)CO)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361192

NCCNS(=O)(=O)c1ccc(-c2cccc(NC[C@@H](N)CO)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361195

NCCNS(=O)(=O)c1ccc(-c2cccc(NC[C@@H](O)CN)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361193

NCCNS(=O)(=O)c1ccc(-c2cccc(NC[C@H](N)CO)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361194

NCCNS(=O)(=O)c1ccc(-c2cccc(NC[C@H](O)CN)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361197

NCCNS(=O)(=O)c1ccc(-c2cccc(SCC(N)CO)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361200

NCCNS(=O)(=O)c1ccc(-c2cccc(SC[C@@H](O)CN)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361199

NCCNS(=O)(=O)c1ccc(-c2cccc(SC[C@H](O)CN)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361196

NCCNS(=O)(=O)c1ccc(-c2cccc(c2)-c2c[nH]c(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361071

NCCNS(=O)(=O)c1ccc(-c2cccc(c2)-c2n[nH]c(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361067

NCCNS(=O)(=O)c1ccc(-c2cccc(c2)-c2nc[nH]n2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361189

NCCNS(=O)(=O)c1ccc(-c2cccc(c2)C(=O)NC[C@H](O)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361187

NCCNS(=O)(=O)c1ccc(-c2cccc(c2)C(=O)N[C@@H]2CNC[C@H]2O)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361298

NCCNS(=O)(=O)c1ccc(-c2cccc3NCCCc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361180

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(CCN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361186

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360856

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361288

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)C(F)(F)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361286

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)C2CNC2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361179

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)[C@@H](N)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361174

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)[C@@H](N)CO)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361287

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)[C@@H]2C[C@@H](O)CN2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361178

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)[C@H](N)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361173

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)[C@H](N)CO)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361042

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361079

NCCNS(=O)(=O)c1ccc(-c2cccc3[nH]nnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361198

NCCNS(=O)(=O)c1ccc(-c2cccc3ccc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360853

NCCNS(=O)(=O)c1ccc(-c2cccc3cn[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM427524

NCCNS(=O)(=O)c1ccc(-c2cccc3ncccc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361082

NCCNS(=O)(=O)c1ccc(-c2cccc3nonc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360855

NCCNS(=O)(=O)c1ccc(-c2cccc3oc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360857

NCCNS(=O)(=O)c1ccc(-c2cccc3oc(nc23)C(O)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361188

NCCNS(=O)(=O)c1ccc(-c2cccc3sc(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360989

NCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361295

NCCNS(=O)(=O)c1ccc(-c2ccccc2NC(=O)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361204

NCCNS(=O)(=O)c1ccc(-c2cccn3ccnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361201

NCCNS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361304

NCCNS(=O)(=O)c1ccc(-c2ccnc(CN)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361243

NCCNS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361202

NCCNS(=O)(=O)c1ccc(-c2cnc3cc[nH]c3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361203

NCCNS(=O)(=O)c1ccc(-c2cncc3ncccc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361181

NCCNS(=O)(=O)c1ccc(C2=CC(N)CCC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |t:11|

BDBM361185

NCCNS(=O)(=O)c1ccc(C2CCC[C@H](N)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530903

NCCNS(=O)(=O)c1ccc(N2CCC(CN)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM530911

NCCNS(=O)(=O)c1ccc(N2CCC(CO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM530885

NCCNS(=O)(=O)c1ccc(N2CCC(O)(CN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM530909

NCCNS(=O)(=O)c1ccc(N2CCN(CCCO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM530916

NCCNS(=O)(=O)c1ccc(N2CCN(CCO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM574731

NCCNS(=O)(=O)c1ccc(cc1)-c1ccn(c1C(O)=O)S(N)(=O)=O

BDBM262847

NCCN[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:7.10,wD:4.3,(-4.67,-.41,;-6,.36,;-6,1.9,;-4.67,2.67,;-3.33,1.9,;-3.33,.36,;-2,-.41,;-.67,.36,;-.67,1.9,;-2,2.67,;.67,-.41,;.67,-1.95,;2,-2.72,;3.33,-1.95,;3.33,-.41,;2,.36,;2,1.9,;.75,2.8,;1.23,4.26,;2.77,4.26,;3.25,2.8,;4.67,.36,;6,1.13,;6,-.41,;5.44,1.69,;4.67,-2.72,;6,-1.95,;4.67,-4.26,;6,-3.49,)|

BDBM361299

NCCNc1cc(ccn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCN

BDBM361300

NCCNc1cc(ccn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCO

BDBM361301

NCCNc1cc(ccn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262781

NCCNc1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262786

NCCNc1nc2c(cccc2s1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM361302

NCCNc1ncccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531077

NCCOC1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM531076

NCCOCC1CCN(CC1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM361046

NCCOCCNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367949

NCCS(=O)(=O)c1ccc(-c2c[nH]c3nccnc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368108

NCCS(=O)(=O)c1ccc(-c2ccc(C#N)c3nc(N)[nH]c23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367958

NCCS(=O)(=O)c1ccc(-c2ccc(CO)nc2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368134

NCCS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367885

NCCS(=O)(=O)c1ccc(-c2ccc(c3sc(N)nc23)C(F)(F)F)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367964

NCCS(=O)(=O)c1ccc(-c2ccc(cc2)-c2nn[nH]n2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368135

NCCS(=O)(=O)c1ccc(-c2ccc(cc2)C2CCNCC2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367957

NCCS(=O)(=O)c1ccc(-c2ccc(nc2)C#N)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367945

NCCS(=O)(=O)c1ccc(-c2ccc(nc2)C2(CNC2)C#N)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367979

NCCS(=O)(=O)c1ccc(-c2ccc3C(=O)NCc3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367953

NCCS(=O)(=O)c1ccc(-c2ccc3CNC(=O)c3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367970

NCCS(=O)(=O)c1ccc(-c2ccc3NC(=O)Cc3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367968

NCCS(=O)(=O)c1ccc(-c2ccc3[nH]c(=O)oc3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367882

NCCS(=O)(=O)c1ccc(-c2ccc3[nH]c(N)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367976

NCCS(=O)(=O)c1ccc(-c2ccc3[nH]nc(c3c2)C(F)(F)F)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367980

NCCS(=O)(=O)c1ccc(-c2ccc3[nH]ncc3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367978

NCCS(=O)(=O)c1ccc(-c2ccc3c(c2)[nH]cnc3=O)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367972

NCCS(=O)(=O)c1ccc(-c2ccc3cccnc3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367959

NCCS(=O)(=O)c1ccc(-c2ccc3nncn3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367987

NCCS(=O)(=O)c1ccc(-c2ccc3scnc3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368190

NCCS(=O)(=O)c1ccc(-c2cccc(C(=O)N[C@@H]3CCNC3)c2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368189

NCCS(=O)(=O)c1ccc(-c2cccc(C(=O)N[C@H]3CCNC3)c2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368012

NCCS(=O)(=O)c1ccc(-c2cccc(C(O)=O)c2N)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368146

NCCS(=O)(=O)c1ccc(-c2cccc(NC(=O)CN)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368151

NCCS(=O)(=O)c1ccc(-c2cccc(NC(=O)CN)c2NC(=O)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368147

NCCS(=O)(=O)c1ccc(-c2cccc(NC(=O)[C@H](N)CO)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368159

NCCS(=O)(=O)c1ccc(-c2cccc(c2)-c2c[nH]c(N)n2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367969

NCCS(=O)(=O)c1ccc(-c2cccc(c2)-n2cccn2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368158

NCCS(=O)(=O)c1ccc(-c2cccc(c2)-n2ccnc2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367971

NCCS(=O)(=O)c1ccc(-c2cccc(c2)N2CCS(=O)(=O)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367974

NCCS(=O)(=O)c1ccc(-c2cccc(c2)S(=O)(=O)NC2CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367960

NCCS(=O)(=O)c1ccc(-c2cccc(n2)N2CCCC2=O)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368160

NCCS(=O)(=O)c1ccc(-c2cccc3C(O)C(=O)Nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367963

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(=O)[nH]c23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368143

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(CC(N)C(O)=O)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368118

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368120

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)C(F)(F)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368121

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)C(F)(F)F)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367904

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)C(O)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368140

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)[C@H](N)CNC(=O)C(F)(F)F)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368142

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)[C@H](N)CO)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368011

NCCS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367886

NCCS(=O)(=O)c1ccc(-c2cccc3cc(N)ncc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368136

NCCS(=O)(=O)c1ccc(-c2cccc3cc([nH]c23)C(N)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367884

NCCS(=O)(=O)c1ccc(-c2cccc3ccc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367986

NCCS(=O)(=O)c1ccc(-c2cccc3cn[nH]c23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367984

NCCS(=O)(=O)c1ccc(-c2cccc3cnccc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368015

NCCS(=O)(=O)c1ccc(-c2cccc3n(C4CNC4)c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367831

NCCS(=O)(=O)c1ccc(-c2cccc3n(CC(F)(F)F)c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367883

NCCS(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368038

NCCS(=O)(=O)c1ccc(-c2cccc3nc(N)nn23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368117

NCCS(=O)(=O)c1ccc(-c2cccc3nc(nn23)C(O)=O)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368137

NCCS(=O)(=O)c1ccc(-c2cccc3ncccc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367900

NCCS(=O)(=O)c1ccc(-c2cccc3sc(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368126

NCCS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367898

NCCS(=O)(=O)c1ccc(-c2cccc3sc(NC(N)=O)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367899

NCCS(=O)(=O)c1ccc(-c2cccc3sc(nc23)C(N)=N)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367902

NCCS(=O)(=O)c1ccc(-c2cccc3sc(nc23)C(N)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367901

NCCS(=O)(=O)c1ccc(-c2cccc3sc(nc23)C(O)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368152

NCCS(=O)(=O)c1ccc(-c2ccccc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM368153

NCCS(=O)(=O)c1ccc(-c2ccccc2NC(=O)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367877

NCCS(=O)(=O)c1ccc(-c2cccn3ccnc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367954

NCCS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368084

NCCS(=O)(=O)c1ccc(-c2ccnc3CCCCc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367955

NCCS(=O)(=O)c1ccc(-c2ccnc3[nH]ccc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367951

NCCS(=O)(=O)c1ccc(-c2ccnc3ccccc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368116

NCCS(=O)(=O)c1ccc(-c2ccnc3nc(N)[nH]c23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367981

NCCS(=O)(=O)c1ccc(-c2cnc(N)c(F)c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM368149

NCCS(=O)(=O)c1ccc(-c2cnc(N)c(c2)C(=O)N[C@H]2CCNC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368148

NCCS(=O)(=O)c1ccc(-c2cnc(N)c(c2)C(N)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM367950

NCCS(=O)(=O)c1ccc(-c2cnc(O)nc2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367962

NCCS(=O)(=O)c1ccc(-c2cnc3[nH]ccc3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367947

NCCS(=O)(=O)c1ccc(-c2cnc3cccnc3c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367956

NCCS(=O)(=O)c1ccc(-c2cncc(CO)c2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367961

NCCS(=O)(=O)c1ccc(-c2cncc3ccccc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM367965

NCCS(=O)(=O)c1ccc(-c2cnn3CCCc23)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM530881

NCCS(=O)(=O)c1ccc(N2CCCCC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM530882

NCCS(=O)(=O)c1ccc(N2CCOCC2)c(-c2nnn[nH]2)c1S(N)(=O)=O

BDBM262883

NCCS(=O)(=O)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262647

NCC[C@H]1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wD:3.2,(-7.24,-7.85,;-5.75,-7.45,;-4.66,-8.54,;-3.17,-8.15,;-2.09,-9.23,;-.6,-8.84,;-.2,-7.35,;-1.29,-6.26,;-2.78,-6.66,;1.29,-6.95,;2.38,-8.04,;3.86,-7.64,;4.32,-6.14,;3.17,-5.06,;1.69,-5.46,;.6,-4.37,;-.94,-4.37,;-1.42,-2.91,;-.17,-2,;1.07,-2.91,;3.57,-3.58,;4.91,-2.81,;3.57,-2.04,;4.91,-4.35,;5.8,-5.74,;7.29,-5.34,;6.2,-7.23,;5.88,-4.2,)|

BDBM262646

NCC[C@H]1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:3.2,(-7.24,-7.85,;-5.75,-7.45,;-4.66,-8.54,;-3.17,-8.15,;-2.78,-6.66,;-1.29,-6.26,;-.2,-7.35,;-.6,-8.84,;-2.09,-9.23,;1.29,-6.95,;2.38,-8.04,;3.86,-7.64,;4.32,-6.14,;3.17,-5.06,;1.69,-5.46,;.6,-4.37,;-.94,-4.37,;-1.42,-2.91,;-.17,-2,;1.07,-2.91,;3.57,-3.58,;4.91,-2.81,;3.57,-2.04,;4.91,-4.35,;5.8,-5.74,;7.29,-5.34,;6.2,-7.23,;5.88,-4.2,)|

BDBM262854

NCCc1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262448

NCCc1ccc(cc1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262455

NCCc1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262881

NCCc1cccc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM368119

NCCc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN

BDBM361122

NCCn1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)N[C@@H]3CCNC3)c2n1 |r|

BDBM361132

NCCn1nnc2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM427453

NCCn1nnc2c(ccnc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361252

NC[C@@H](CO)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361317

NC[C@@H](CO)NS(=O)(=O)c1ccc(-c2ccc3[nH]c(CN)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361318

NC[C@@H](CO)NS(=O)(=O)c1ccc(-c2ccc3sc(CN)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361225

NC[C@@H](CO)NS(=O)(=O)c1ccc(-c2cccc(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361222

NC[C@@H](CO)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361224

NC[C@@H](CO)NS(=O)(=O)c1ccc(-c2cccc3sc(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361223

NC[C@@H](CO)NS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531057

NC[C@@H](CO)NS(=O)(=O)c1ccc(N2CCC(CN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368171

NC[C@@H](CO)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361259

NC[C@@H](N)CNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361073

NC[C@@H](N)CNS(=O)(=O)c1ccc(-c2cccc(c2)-c2n[nH]c(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361218

NC[C@@H](N)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361219

NC[C@@H](N)CNS(=O)(=O)c1ccc(-c2cccc3ccc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361220

NC[C@@H](N)CNS(=O)(=O)c1ccc(-c2cnc(N)s2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361221

NC[C@@H](N)CNS(=O)(=O)c1ccc(-c2cnc3cc[nH]c3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368184

NC[C@@H](N)CS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368173

NC[C@@H](N)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2cn[nH]n2)c1S(N)(=O)=O |r|

BDBM361146

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361307

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2ccc3[nH]c(CN)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361263

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2ccc3nccn3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361306

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2ccc3sc(CN)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361142

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361141

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361144

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361143

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2cccc3sc(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361262

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361321

NC[C@@H](O)CNS(=O)(=O)c1ccc(-c2cnc(N)c(F)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531040

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC3CCC(C2)C3CN)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,TLB:21:20:19.13.14:16.17|

BDBM531038

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC=C(CN)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,t:15|

BDBM530986

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(C2)C(N)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530893

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC(N)=O)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531049

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC2)C(N)CO)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531000

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC2)C(O)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531045

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC2)C2COC(=O)N2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531010

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC2)NCCO)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531048

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC2)[C@@H](N)CO)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531037

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC2)c2c[nH]cn2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM531069

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC2)c2ncc[nH]2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531042

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CC2)n2ccnc2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530895

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CCn3cccn3)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531043

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CN)=CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,c:18|

BDBM530902

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CN)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530991

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CNCCO)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530910

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(CO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530870

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(F)(CN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530890

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(F)(CO)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531062

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(N)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530988

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC(O)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530894

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC3(CC2)CNC(=O)OC3)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530879

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC3(CC3N)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531001

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC3(CCNC3)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531039

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC3(CNC(N)=N3)CC2)c(c1S(N)(=O)=O)[N]1=NNN=N1 |r,c:20,36,t:33|

BDBM531009

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC3CNCC3C2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM531007

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCCC(CN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530891

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCCN(CCO)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530906

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC[C@@H](CN)C2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530998

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC[C@H](C2)NCCO)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530907

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCC[C@H](CN)C2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM531005

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCN(CC([O-])=O)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530987

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCN(CC2)C(=O)CN)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531028

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCN(CC2)C(CO)CO)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530908

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCN(CCCO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM531014

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCN(CCO)C(=O)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530915

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCN(CCO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530997

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCN3CCOCC3C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530990

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCNC(CO)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530888

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CCOC(CO)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530989

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@@H](CN)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530873

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@@H](CN)[C@@H](F)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530993

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@@H](N)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530700

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@@H](N)[C@@H](F)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530709

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@@H](N)[C@H](F)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530992

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@H](CN)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530880

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@H](CN)[C@@H](F)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530877

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@H](CN)[C@@H](O)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530876

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@H](CN)[C@H](O)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530994

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@H](N)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531063

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2CC[C@H](N)[C@H](F)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531029

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2C[C@@H]3CNC[C@@H]3C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530878

NC[C@@H](O)CNS(=O)(=O)c1ccc(N2C[C@H]3[C@H](CN)[C@H]3C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531060

NC[C@@H](O)CNS(=O)(=O)c1ccc(NC2CC(N)C2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r,wU:2.2,(7.47,-.28,;5.93,-.28,;5.16,-1.61,;5.93,-2.94,;3.62,-1.61,;2.85,-.28,;1.31,-.28,;1.31,-1.82,;1.31,1.26,;-.23,-.28,;-1,-1.61,;-2.54,-1.61,;-3.31,-.28,;-4.85,-.28,;-5.62,-1.61,;-7.1,-2.01,;-6.7,-3.5,;-7.47,-4.83,;-5.22,-3.1,;-2.54,1.06,;-3.31,2.39,;-4.84,2.55,;-5.16,4.06,;-3.82,4.83,;-2.68,3.8,;-.97,1.11,;-.2,2.44,;.57,3.77,;-1.53,3.21,;1.31,2.12,)|

BDBM531052

NC[C@@H](O)CNS(=O)(=O)c1ccc(NC2CCC(N)C2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531047

NC[C@@H](O)CNS(=O)(=O)c1ccc(N[C@@H]2CCC[C@H]2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531011

NC[C@@H](O)CNS(=O)(=O)c1ccc(N[C@@H]2C[C@H](N)C2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r,wU:14.13,16.16,2.2,(7.47,-.24,;5.93,-.24,;5.16,-1.58,;5.93,-2.91,;3.62,-1.58,;2.85,-.24,;1.31,-.24,;1.31,1.3,;1.31,-1.78,;-.23,-.24,;-1,-1.58,;-2.54,-1.58,;-3.31,-.24,;-4.85,-.24,;-5.62,-1.58,;-7.1,-1.97,;-6.7,-3.46,;-7.47,-4.8,;-5.22,-3.06,;-2.54,1.09,;-3.31,2.43,;-4.85,2.43,;-5.32,3.89,;-4.08,4.8,;-2.83,3.89,;-.97,1.14,;-.2,2.47,;1.31,2.15,;.57,3.81,;-1.53,3.24,)|

BDBM531046

NC[C@@H](O)CNS(=O)(=O)c1ccc(N[C@H]2CCC[C@H]2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531071

NC[C@@H](O)CNS(=O)(=O)c1ccc(Nc2ncc[nH]2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368192

NC[C@@H](O)CS(=O)(=O)c1ccc(-c2cc(I)cc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368177

NC[C@@H](O)CS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368183

NC[C@@H](O)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368125

NC[C@@H](O)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368174

NC[C@@H](O)CS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368165

NC[C@@H](O)CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368180

NC[C@@H](O)CS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530996

NC[C@@H](O)CS(=O)(=O)c1ccc(N2CCC(CN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530946

NC[C@@H]1CCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361097

NC[C@@H]1CCN(C1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM360914

NC[C@@H]1CCN(C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530874

NC[C@@H]1CCN(C[C@@H]1F)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361268

NC[C@@H]1C[C@H](CN1)NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM427650

NC[C@@]1(CCNC1)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361251

NC[C@H](CO)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361207

NC[C@H](CO)NS(=O)(=O)c1ccc(-c2cccc(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361250

NC[C@H](CO)NS(=O)(=O)c1ccc(-c2cccc3[nH]nnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361270

NC[C@H](CO)NS(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361206

NC[C@H](CO)NS(=O)(=O)c1ccc(-c2cccc3sc(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361045

NC[C@H](CO)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM361058

NC[C@H](CO)NS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361205

NC[C@H](CO)NS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531054

NC[C@H](CO)NS(=O)(=O)c1ccc(N2CCC(CN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368164

NC[C@H](CO)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM262984

NC[C@H](N)C(=O)NC1CCC(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:2.2,(-8.8,-.49,;-7.47,.28,;-6.13,-.49,;-6.13,-2.03,;-4.8,.28,;-4.8,1.82,;-3.31,-.12,;-1.98,-.89,;-1.21,.45,;.28,.03,;1.76,.45,;.99,-.89,;-.5,-.46,;3.25,.05,;2.85,-1.44,;3.94,-2.53,;5.47,-2.22,;5.83,-.64,;4.74,.45,;5.14,1.94,;3.89,2.84,;4.37,4.31,;5.91,4.31,;6.38,2.84,;7.31,-.24,;8.8,-.64,;8.4,.85,;7.71,-1.73,;6.55,-3.32,;7.62,-4.42,;5.44,-4.39,;7.65,-2.24,)|

BDBM361258

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361277

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2cccc(c2)-c2c[nH]c(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361213

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361214

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2cccc3ccc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361217

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2cccn3ccnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361056

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361260

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361215

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2cnc(N)s2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361216

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2cnc3cc[nH]c3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361066

NC[C@H](N)CNS(=O)(=O)c1ccc(-c2cnccc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531036

NC[C@H](N)CNS(=O)(=O)c1ccc(N2CCC(CC2)c2c[nH]cn2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531068

NC[C@H](N)CNS(=O)(=O)c1ccc(N2CCC(CN)CC2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530912

NC[C@H](N)CNS(=O)(=O)c1ccc(N2CCC(CO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530917

NC[C@H](N)CNS(=O)(=O)c1ccc(N2CCN(CCO)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM368185

NC[C@H](N)CS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368106

NC[C@H](N)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM361152

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361308

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2ccc3[nH]c(CN)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361261

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2ccc3nccn3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361316

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2ccc3sc(CN)nc3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361148

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361147

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361150

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361149

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2cccc3sc(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM427581

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2ccnc(N)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361065

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2ccncc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361312

NC[C@H](O)CNS(=O)(=O)c1ccc(-c2cnc(N)c(F)c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM530905

NC[C@H](O)CNS(=O)(=O)c1ccc(N2CCC(CN)CC2)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM368178

NC[C@H](O)CS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368179

NC[C@H](O)CS(=O)(=O)c1ccc(-c2cccc(c2)-c2c[nH]c(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368182

NC[C@H](O)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(CN)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368095

NC[C@H](O)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368166

NC[C@H](O)CS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368094

NC[C@H](O)CS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368181

NC[C@H](O)CS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM262736

NC[C@H]1CCC(CC1)c1ccc(CC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O |r,wU:2.1,(-6.92,-9.01,;-6.15,-7.67,;-4.61,-7.67,;-3.84,-6.34,;-2.3,-6.34,;-1.53,-7.67,;-2.3,-9.01,;-3.84,-9.01,;.01,-7.67,;.78,-9.01,;2.32,-9.01,;3.09,-7.67,;4.63,-7.67,;5.03,-9.16,;3.94,-10.25,;4.34,-11.74,;5.83,-12.14,;6.92,-11.05,;6.52,-9.56,;2.32,-6.34,;.78,-6.34,;.01,-5.01,;-1.53,-5.01,;-2,-3.54,;-.76,-2.64,;.49,-3.54,;3.09,-5.01,;4.43,-5.78,;1.76,-4.24,;3.86,-3.67,)|

BDBM530950

NC[C@H]1CCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361096

NC[C@H]1CCN(C1)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM262738

NC[C@H]1CC[C@@H](CC1)c1ccc(CCC2CCNCC2)c(c1-c1nnn[nH]1)S(N)(=O)=O |r,wU:2.1,wD:5.8,(-8.18,-4,;-7.78,-2.51,;-6.3,-2.11,;-5.9,-.62,;-4.41,-.23,;-3.32,-1.31,;-3.72,-2.8,;-5.21,-3.2,;-1.83,-.92,;-.74,-2,;.74,-1.61,;1.14,-.12,;2.63,.28,;3.72,-.81,;5.21,-.41,;6.3,-1.5,;7.78,-1.1,;8.18,.39,;7.09,1.48,;5.6,1.08,;.05,.97,;-1.43,.57,;-2.52,1.66,;-3.99,1.18,;-4.89,2.43,;-3.99,3.68,;-2.52,3.2,;.45,2.46,;1.79,3.23,;.45,4,;1.94,2.06,)|

BDBM262648

NC[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:2.1,wD:5.8,(-6.49,-7.56,;-5.41,-8.65,;-3.92,-8.25,;-3.52,-6.77,;-2.03,-6.37,;-.94,-7.46,;-1.34,-8.94,;-2.83,-9.34,;.54,-7.06,;1.63,-8.15,;3.12,-7.75,;3.57,-6.25,;2.43,-5.17,;.94,-5.57,;-.15,-4.48,;-1.69,-4.48,;-2.16,-3.02,;-.92,-2.11,;.33,-3.02,;2.83,-3.68,;4.16,-2.91,;2.83,-2.14,;4.16,-4.45,;5.06,-5.85,;6.55,-5.45,;5.46,-7.34,;5.14,-4.31,)|

BDBM262727

NC[C@H]1CC[C@@H](Cc2ccc(-c3ccc(N)nc3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:5.5,2.1,(7.7,-5.19,;6.16,-5.19,;5.39,-3.85,;3.85,-3.85,;3.08,-2.52,;3.85,-1.18,;3.08,.15,;1.54,.15,;.77,-1.18,;-.77,-1.18,;-1.54,.15,;-3.08,.15,;-3.85,-1.18,;-5.39,-1.18,;-6.16,.15,;-7.7,.15,;-5.39,1.48,;-3.85,1.48,;-.77,1.48,;-1.54,2.82,;-3.08,2.82,;-3.56,4.28,;-2.31,5.19,;-1.06,4.28,;.8,1.53,;1.57,2.86,;2.9,2.09,;2.34,4.2,;.23,3.63,;5.39,-1.18,;6.16,-2.52,)|

BDBM262734

NC[C@H]1CC[C@@H](Cc2ccc(-c3ccc(cc3)C3CCNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:5.5,2.1,(9.1,-5.33,;7.56,-5.33,;6.79,-3.99,;5.3,-4.39,;4.21,-3.3,;4.61,-1.81,;3.84,-.48,;2.51,.29,;1.74,-1.04,;.2,-1.04,;-.57,.29,;-2.11,.29,;-2.88,-1.04,;-4.42,-1.04,;-5.19,.29,;-4.42,1.62,;-2.88,1.62,;-6.73,.29,;-7.64,1.53,;-9.1,1.06,;-9.1,-.48,;-7.64,-.96,;.2,1.62,;-.57,2.96,;-2.11,2.96,;-2.59,4.42,;-1.34,5.33,;-.1,4.42,;1.74,1.62,;2.51,2.96,;3.84,2.19,;3.84,3.73,;1.74,4.29,;6.1,-1.42,;7.19,-2.51,)|

BDBM262749

NC[C@H]1CC[C@@H](Cc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:5.5,2.1,(6.28,-6.96,;4.94,-6.19,;4.94,-4.65,;3.61,-3.88,;3.61,-2.34,;4.94,-1.57,;4.94,-.03,;3.61,.74,;2.28,-.03,;.94,.74,;.94,2.28,;-.39,3.05,;-.39,4.59,;-1.72,5.36,;-3.06,4.59,;-3.06,3.05,;-1.72,2.28,;-4.39,5.36,;-4.79,6.85,;-6.28,6.45,;-5.88,4.96,;2.28,3.05,;2.28,4.59,;1.03,5.5,;1.51,6.96,;3.05,6.96,;3.52,5.5,;3.66,2.31,;4.99,3.08,;5.76,1.74,;6.33,3.85,;4.22,4.41,;6.28,-2.34,;6.28,-3.88,)|

BDBM262737

NC[C@H]1CC[C@H](CC1)c1ccc(CC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O |r,wU:5.8,2.1,(-6.92,-9.01,;-6.15,-7.67,;-4.61,-7.67,;-3.84,-6.34,;-2.3,-6.34,;-1.53,-7.67,;-2.3,-9.01,;-3.84,-9.01,;.01,-7.67,;.78,-9.01,;2.32,-9.01,;3.09,-7.67,;4.63,-7.67,;5.03,-9.16,;3.94,-10.25,;4.34,-11.74,;5.83,-12.14,;6.92,-11.05,;6.52,-9.56,;2.32,-6.34,;.78,-6.34,;.01,-5.01,;-1.53,-5.01,;-2,-3.54,;-.76,-2.64,;.49,-3.54,;3.09,-5.01,;4.43,-5.78,;1.76,-4.24,;3.86,-3.67,)|

BDBM262739

NC[C@H]1CC[C@H](CC1)c1ccc(CCC2CCNCC2)c(c1-c1nnn[nH]1)S(N)(=O)=O |r,wU:5.8,2.1,(-8.18,-4,;-7.78,-2.51,;-6.3,-2.11,;-5.9,-.62,;-4.41,-.23,;-3.32,-1.31,;-3.72,-2.8,;-5.21,-3.2,;-1.83,-.92,;-.74,-2,;.74,-1.61,;1.14,-.12,;2.63,.28,;3.72,-.81,;5.21,-.41,;6.3,-1.5,;7.78,-1.1,;8.18,.39,;7.09,1.48,;5.6,1.08,;.05,.97,;-1.43,.57,;-2.52,1.66,;-3.99,1.18,;-4.89,2.43,;-3.99,3.68,;-2.52,3.2,;.45,2.46,;1.79,3.23,;.45,4,;1.94,2.06,)|

BDBM262649

NC[C@H]1CC[C@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wD:5.8,2.1,(-6.49,-7.56,;-5.41,-8.65,;-3.92,-8.25,;-2.83,-9.34,;-1.34,-8.94,;-.94,-7.46,;-2.03,-6.37,;-3.52,-6.77,;.54,-7.06,;1.63,-8.15,;3.12,-7.75,;3.57,-6.25,;2.43,-5.17,;.94,-5.57,;-.15,-4.48,;-1.69,-4.48,;-2.16,-3.02,;-.92,-2.11,;.33,-3.02,;2.83,-3.68,;4.16,-2.91,;2.83,-2.14,;4.16,-4.45,;5.06,-5.85,;6.55,-5.45,;5.46,-7.34,;5.14,-4.31,)|

BDBM262726

NC[C@H]1CC[C@H](Cc2ccc(-c3ccc(N)nc3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:5.5,wD:2.1,(7.7,-5.19,;6.16,-5.19,;5.39,-3.85,;6.16,-2.52,;5.39,-1.18,;3.85,-1.18,;3.08,.15,;1.54,.15,;.77,-1.18,;-.77,-1.18,;-1.54,.15,;-3.08,.15,;-3.85,-1.18,;-5.39,-1.18,;-6.16,.15,;-7.7,.15,;-5.39,1.48,;-3.85,1.48,;-.77,1.48,;-1.54,2.82,;-3.08,2.82,;-3.56,4.28,;-2.31,5.19,;-1.06,4.28,;.8,1.53,;1.57,2.86,;2.9,2.09,;2.34,4.2,;.23,3.63,;3.08,-2.52,;3.85,-3.85,)|

BDBM262733

NC[C@H]1CC[C@H](Cc2ccc(-c3ccc(cc3)C3CCNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:5.5,wD:2.1,(9.1,-5.33,;7.56,-5.33,;6.79,-3.99,;7.19,-2.51,;6.1,-1.42,;4.61,-1.81,;3.84,-.48,;2.51,.29,;1.74,-1.04,;.2,-1.04,;-.57,.29,;-2.11,.29,;-2.88,-1.04,;-4.42,-1.04,;-5.19,.29,;-4.42,1.62,;-2.88,1.62,;-6.73,.29,;-7.64,1.53,;-9.1,1.06,;-9.1,-.48,;-7.64,-.96,;.2,1.62,;-.57,2.96,;-2.11,2.96,;-2.59,4.42,;-1.34,5.33,;-.1,4.42,;1.74,1.62,;2.51,2.96,;3.84,2.19,;3.84,3.73,;2.51,4.5,;4.21,-3.3,;5.3,-4.39,)|

BDBM262605

NC[C@H]1CC[C@H](Cc2ccc(-c3ccc(cc3)C3CCNCC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |r,wU:5.5,wD:2.1,(9.24,-5.19,;7.7,-5.19,;6.93,-3.85,;7.7,-2.52,;6.93,-1.18,;5.39,-1.18,;4.62,.15,;3.08,.15,;2.31,-1.18,;.77,-1.18,;,.15,;-1.54,.15,;-2.31,1.48,;-3.85,1.48,;-4.62,.15,;-3.85,-1.18,;-2.31,-1.18,;-6.16,.15,;-6.93,1.48,;-8.47,1.48,;-9.24,.15,;-8.47,-1.18,;-6.93,-1.18,;.77,1.48,;,2.82,;-1.54,2.82,;-2.02,4.28,;-.77,5.19,;.48,4.28,;2.31,1.48,;3.08,2.82,;4.57,2.42,;3.85,4.15,;1.75,3.59,;4.62,-2.52,;5.39,-3.85,)|

BDBM262748

NC[C@H]1CC[C@H](Cc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:5.5,wD:2.1,(6.28,-6.96,;4.94,-6.19,;4.94,-4.65,;6.28,-3.88,;6.28,-2.34,;4.94,-1.57,;4.94,-.03,;3.61,.74,;2.28,-.03,;.94,.74,;.94,2.28,;-.39,3.05,;-.39,4.59,;-1.72,5.36,;-3.06,4.59,;-3.06,3.05,;-1.72,2.28,;-4.39,5.36,;-4.79,6.85,;-6.28,6.45,;-5.88,4.96,;2.28,3.05,;2.28,4.59,;1.03,5.5,;1.51,6.96,;3.05,6.96,;3.52,5.5,;3.66,2.31,;4.99,3.08,;5.76,1.74,;6.33,3.85,;4.22,4.41,;3.61,-2.34,;3.61,-3.88,)|

BDBM361329

NC[C@]1(CCNC1)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM531073

NC\C=C1/CCCN(C1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H](O)CN |r|

BDBM262419

NCc1ccc(cc1)-c1ccc(Br)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262740

NCc1ccc(cc1)-c1ccc(CC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262587

NCc1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262454

NCc1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262434

NCc1ccc2cc(ccc2n1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367920

NCc1cncc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361133

NCc1csc(Nc2cccc(c2)-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)N[C@@H]2CCNC2)n1 |r|

BDBM361305

NCc1nc(c[nH]1)-c1cccc(c1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CNC[C@H]1N |r|

BDBM262397

NCc1nc(no1)-c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM361154

NCc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nc[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CNCCN1 |r|

BDBM427475

NCc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CNCCN1 |r|

BDBM361126

NCc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361119

NCc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361117

NCc1nc2cc(ccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361118

NCc1nc2cc(ccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262660

NCc1ncc(CCc2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)C(F)(F)F)cc1N

BDBM361121

NCc1ncc([nH]1)-c1cccc(c1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262428

NCc1nccc2cc(ccc12)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM361275

NCc1sc(N)nc1-c1cccc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531018

NOC1CCCN(C1=O)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530948

NS(=O)(=O)C1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262884

NS(=O)(=O)Cc1cccc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262573

NS(=O)(=O)c1c(Br)ccc(-c2ccc(CNC=N)cc2)c1-c1nn[nH]n1

BDBM262407

NS(=O)(=O)c1c(Br)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nnn[nH]1

BDBM262420

NS(=O)(=O)c1c(Br)ccc(-c2ccc3CNCc3c2)c1-c1nn[nH]n1

BDBM262414

NS(=O)(=O)c1c(Br)ccc(-c2ccnc3ccccc23)c1-c1nn[nH]n1

BDBM262606

NS(=O)(=O)c1c(CC(F)(F)F)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262615

NS(=O)(=O)c1c(CC2(F)CCNC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262612

NS(=O)(=O)c1c(CC2(F)CCNCC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262619

NS(=O)(=O)c1c(CC2CCN(CC3CNC3)CC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262754

NS(=O)(=O)c1c(CC2CCN(CCO)CC2)ccc(-c2ccc(cc2)C2CNC2)c1-c1nn[nH]n1

BDBM262616

NS(=O)(=O)c1c(CC2CCNC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262613

NS(=O)(=O)c1c(CC2CCNCC2(F)F)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262618

NS(=O)(=O)c1c(CC2CCNCC2)ccc(-c2ccc(cc2)C2CCN(CC3CNC3)CC2)c1-c1nn[nH]n1

BDBM262735

NS(=O)(=O)c1c(CC2CCNCC2)ccc(-c2ccc(cc2)C2CCNC2)c1-c1nn[nH]n1

BDBM262604

NS(=O)(=O)c1c(CC2CCNCC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262755

NS(=O)(=O)c1c(CC2CCNCC2)ccc(-c2ccc(cc2)C2CN(CCO)C2)c1-c1nn[nH]n1

BDBM262744

NS(=O)(=O)c1c(CC2CCNCC2)ccc(-c2ccc(cc2)C2CNC2)c1-c1nnn[nH]1

BDBM262617

NS(=O)(=O)c1c(CC2CNC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262693

NS(=O)(=O)c1c(CC2CNC2)ccc(-c2cnc3ccccn23)c1-c1nn[nH]n1

BDBM262601

NS(=O)(=O)c1c(CCC#N)ccc(-c2ccnc3ccccc23)c1-c1nn[nH]n1

BDBM262621

NS(=O)(=O)c1c(CCC(F)(F)F)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262745

NS(=O)(=O)c1c(CCC2CCNCC2)ccc(-c2ccc(cc2)C2CNC2)c1-c1nnn[nH]1

BDBM262600

NS(=O)(=O)c1c(CCC2CCNCC2)ccc(-c2ccnc3ccccc23)c1-c1nn[nH]n1

BDBM262614

NS(=O)(=O)c1c(CCC2CNC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262690

NS(=O)(=O)c1c(CCCCCCO)ccc(CCCCCCO)c1-c1nn[nH]n1

BDBM262689

NS(=O)(=O)c1c(CCCCCO)ccc(CCCCCO)c1-c1nn[nH]n1

BDBM262677

NS(=O)(=O)c1c(CCO)ccc(-c2cccc3ncccc23)c1-c1nn[nH]n1

BDBM262409

NS(=O)(=O)c1c(Cc2ccccc2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nnn[nH]1

BDBM262424

NS(=O)(=O)c1c(Cl)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM368039

NS(=O)(=O)c1c(SC2CCNCC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nnn[nH]1

BDBM368056

NS(=O)(=O)c1c(SC2CNC2)ccc(-c2ccc(NS(=O)(=O)C3CC3)cc2)c1-c1nn[nH]n1

BDBM367689

NS(=O)(=O)c1c(SC2CNC2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM367876

NS(=O)(=O)c1c(SC2CNC2)ccc(-c2cccc3nccn23)c1-c1nnn[nH]1

BDBM367820

NS(=O)(=O)c1c(SC2CNC2)ccc(-c2cnc3ccccn23)c1-c1nn[nH]n1

BDBM368055

NS(=O)(=O)c1c(Sc2ccncc2)ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262865

NS(=O)(=O)c1c(ccc(-c2ccc(CN3CCNCC3)cc2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262593

NS(=O)(=O)c1c(ccc(-c2ccc(CO)cc2)c1-c1nn[nH]n1)C(F)(F)F

BDBM367924

NS(=O)(=O)c1c(ccc(-c2ccc(CO)nc2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM368058

NS(=O)(=O)c1c(ccc(-c2ccc(NS(=O)(=O)C3CC3)cc2)c1-c1nn[nH]n1)S(=O)(=O)C1CN(C1)C(=O)NC1CC1

BDBM368057

NS(=O)(=O)c1c(ccc(-c2ccc(NS(=O)(=O)C3CC3)cc2)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM367922

NS(=O)(=O)c1c(ccc(-c2ccc(O)nc2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262866

NS(=O)(=O)c1c(ccc(-c2ccc(OC3CNC3)cc2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262706

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)-c2c[nH]c(O)[nH+]2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262711

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C(=N)NC2CCNC2)c1-c1nn[nH]n1)C(F)(F)F

BDBM262710

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C(=N)NC2CNC2)c1-c1nn[nH]n1)C(F)(F)F

BDBM262885

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C(O)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262863

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCCN2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262944

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC2)C2CC3(C2)CCNCC3)c1-c1nnn[nH]1)C(F)(F)F

BDBM262935

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC2)C2CC3CCC2N3)c1-c1nnn[nH]1)C(F)(F)F

BDBM262936

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC2)C2CCNC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262932

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC2)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262943

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC2)C2CNC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262823

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC3CCCCN3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262820

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC3CCCNC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262942

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC3CCNC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262815

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC3CCNCC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262818

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CC3CNC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262940

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(CCC3CCNCC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262816

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(C[C@@H]3CCCN3)CC2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM262825

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(C[C@@H]3CNCCO3)CC2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM262822

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(C[C@H]3CCCN3)CC2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM262817

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCN(C[C@H]3CNCCO3)CC2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM262591

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCNC2)c1-c1nn[nH]n1)C(F)(F)F

BDBM262578

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1)-c1ccc(cc1)C1CCNCC1

BDBM262417

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1)C(F)(F)F

BDBM367819

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM367818

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1)S(=O)C1CNC1

BDBM368041

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nnn[nH]1)S(=O)(=O)C1CCNCC1

BDBM368040

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CCNCC2)c1-c1nnn[nH]1)S(=O)C1CCNCC1

BDBM262952

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CN(C2)C2CC3(C2)CCNCC3)c1-c1nnn[nH]1)C(F)(F)F

BDBM262948

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CN(C2)C2CCNC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262949

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CN(C2)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262965

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CN(CC3CCNC3)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262951

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CN(CC3CCNCC3)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262947

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CN(CC3CNC3)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262950

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CN(CCC3CCNCC3)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262581

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CNC2)c1-c1nn[nH]n1)C(F)(F)F

BDBM262860

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)C2CNCCO2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262887

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)N2CCC(O)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262864

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)N2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262889

NS(=O)(=O)c1c(ccc(-c2ccc(cc2)S(=O)(=O)CCO)c1-c1nnn[nH]1)C(F)(F)F

BDBM262891

NS(=O)(=O)c1c(ccc(-c2ccc(nc2)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262893

NS(=O)(=O)c1c(ccc(-c2ccc3C(=O)NCc3c2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262867

NS(=O)(=O)c1c(ccc(-c2ccc3CCNCc3c2)c1-c1nnn[nH]1)C(F)(F)F

BDBM360982

NS(=O)(=O)c1c(ccc(-c2ccc3CNC(=O)c3c2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262868

NS(=O)(=O)c1c(ccc(-c2ccc3CNCCc3c2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262589

NS(=O)(=O)c1c(ccc(-c2ccc3CNCc3c2)c1-c1nn[nH]n1)C(F)(F)F

BDBM262862

NS(=O)(=O)c1c(ccc(-c2ccc3CNCc3c2)c1-c1nnn[nH]1)C(F)(F)F

BDBM367944

NS(=O)(=O)c1c(ccc(-c2ccc3ccncc3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367940

NS(=O)(=O)c1c(ccc(-c2ccc3cn[nH]c3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367929

NS(=O)(=O)c1c(ccc(-c2ccc3cnccc3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367928

NS(=O)(=O)c1c(ccc(-c2ccc3ncccc3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262629

NS(=O)(=O)c1c(ccc(-c2ccc3nccn3c2)c1-c1nnn[nH]1)C(F)(F)F

BDBM367930

NS(=O)(=O)c1c(ccc(-c2ccc3nccnc3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367917

NS(=O)(=O)c1c(ccc(-c2ccc3ncnn3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM360977

NS(=O)(=O)c1c(ccc(-c2ccc3nonc3c2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM367927

NS(=O)(=O)c1c(ccc(-c2ccc3scnc3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM361313

NS(=O)(=O)c1c(ccc(-c2cccc(Nc3nc(CO)cs3)c2)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361315

NS(=O)(=O)c1c(ccc(-c2cccc(Nc3ncc[nH]3)c2)c1-c1nn[nH]n1)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM361068

NS(=O)(=O)c1c(ccc(-c2cccc(c2)-c2nc[nH]n2)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1

BDBM367938

NS(=O)(=O)c1c(ccc(-c2cccc(c2)C2CCC(=O)N2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262869

NS(=O)(=O)c1c(ccc(-c2cccc(c2)C2CCNC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262888

NS(=O)(=O)c1c(ccc(-c2cccc(c2)N2CCC(O)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262886

NS(=O)(=O)c1c(ccc(-c2cccc(c2)N2CCCC(O)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262870

NS(=O)(=O)c1c(ccc(-c2cccc(c2)N2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM368060

NS(=O)(=O)c1c(ccc(-c2cccc(c2)S(=O)=O)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM262672

NS(=O)(=O)c1c(ccc(-c2cccc3C(=O)NCc23)c1-c1nn[nH]n1)C(F)(F)F

BDBM368131

NS(=O)(=O)c1c(ccc(-c2cccc3C(=O)NCc23)c1-c1nn[nH]n1)S(=O)(=O)C1CCNCC1

BDBM367926

NS(=O)(=O)c1c(ccc(-c2cccc3C(=O)NCc23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262664

NS(=O)(=O)c1c(ccc(-c2cccc3CNCCc23)c1-c1nn[nH]n1)C(F)(F)F

BDBM262665

NS(=O)(=O)c1c(ccc(-c2cccc3NCCCc23)c1-c1nnn[nH]1)C(F)(F)F

BDBM262871

NS(=O)(=O)c1c(ccc(-c2cccc3NCCOc23)c1-c1nnn[nH]1)C(F)(F)F

BDBM360975

NS(=O)(=O)c1c(ccc(-c2cccc3OC(F)(F)Oc23)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262661

NS(=O)(=O)c1c(ccc(-c2cccc3[n+]([O-])cccc23)c1-c1nn[nH]n1)C(F)(F)F

BDBM368133

NS(=O)(=O)c1c(ccc(-c2cccc3[n+]([O-])cccc23)c1-c1nn[nH]n1)S(=O)(=O)CCO

BDBM368112

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]c(=O)[nH]c23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM368070

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]c(nc23)C(=O)NCC(O)=O)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM368066

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]c(nc23)C(O)=O)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM368145

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]cnc23)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM361324

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]cnc23)c1-c1nn[nH]n1)S(=O)(=O)NC[C@H]1CNCCN1 |r|

BDBM361036

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]cnc23)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361040

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]cnc23)c1-c1nn[nH]n1)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM367913

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]ncc23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM361078

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]nnc23)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361255

NS(=O)(=O)c1c(ccc(-c2cccc3[nH]nnc23)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CNC[C@@H]1O |r|

BDBM368062

NS(=O)(=O)c1c(ccc(-c2cccc3c2C(=O)NS3(=O)=O)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM262663

NS(=O)(=O)c1c(ccc(-c2cccc3c[n+]([O-])ccc23)c1-c1nn[nH]n1)C(F)(F)F

BDBM367941

NS(=O)(=O)c1c(ccc(-c2cccc3cccnc23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367915

NS(=O)(=O)c1c(ccc(-c2cccc3ccnn23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367998

NS(=O)(=O)c1c(ccc(-c2cccc3cn[nH]c23)c1-c1nn[nH]n1)S(=O)(=O)[C@@H]1CCNC1 |r|

BDBM367999

NS(=O)(=O)c1c(ccc(-c2cccc3cn[nH]c23)c1-c1nn[nH]n1)S(=O)(=O)[C@H]1CCNC1 |r|

BDBM368110

NS(=O)(=O)c1c(ccc(-c2cccc3cn[nH]c23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM361003

NS(=O)(=O)c1c(ccc(-c2cccc3cn[nH]c23)c1-c1nnn[nH]1)S(=O)(=O)N1CCNCC1

BDBM360983

NS(=O)(=O)c1c(ccc(-c2cccc3cn[nH]c23)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262662

NS(=O)(=O)c1c(ccc(-c2cccc3cnccc23)c1-c1nn[nH]n1)C(F)(F)F

BDBM360974

NS(=O)(=O)c1c(ccc(-c2cccc3nc(O)[nH]c23)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM368103

NS(=O)(=O)c1c(ccc(-c2cccc3nc([nH]c23)C(O)=O)c1-c1nn[nH]n1)S(=O)(=O)[C@H]1CCNC1 |r|

BDBM262634

NS(=O)(=O)c1c(ccc(-c2cccc3ncccc23)c1-c1nn[nH]n1)C(F)(F)F

BDBM262676

NS(=O)(=O)c1c(ccc(-c2cccc3ncccc23)c1-c1nn[nH]n1)C1CC1

BDBM361130

NS(=O)(=O)c1c(ccc(-c2cccc3ncccc23)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM367931

NS(=O)(=O)c1c(ccc(-c2cccc3ncccc23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367879

NS(=O)(=O)c1c(ccc(-c2cccc3nccn23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM361081

NS(=O)(=O)c1c(ccc(-c2cccc3nonc23)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM368122

NS(=O)(=O)c1c(ccc(-c2cccc3sc(O)nc23)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM262631

NS(=O)(=O)c1c(ccc(-c2cccc3sc(nc23)C#N)c1-c1nnn[nH]1)C(F)(F)F

BDBM367881

NS(=O)(=O)c1c(ccc(-c2cccc3sc(nc23)C(O)=O)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM368014

NS(=O)(=O)c1c(ccc(-c2cccc3scnc23)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM367874

NS(=O)(=O)c1c(ccc(-c2cccn3cc(nc23)C(O)=O)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM361134

NS(=O)(=O)c1c(ccc(-c2cccn3ccnc23)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM367871

NS(=O)(=O)c1c(ccc(-c2cccn3ccnc23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262633

NS(=O)(=O)c1c(ccc(-c2cccn3cncc23)c1-c1nnn[nH]1)C(F)(F)F

BDBM367873

NS(=O)(=O)c1c(ccc(-c2cccn3cncc23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262987

NS(=O)(=O)c1c(ccc(-c2cccn3nc[nH+]c23)c1-c1nnn[nH]1)C(F)(F)F

BDBM361063

NS(=O)(=O)c1c(ccc(-c2cccnc2N2CCNCC2)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1

BDBM368033

NS(=O)(=O)c1c(ccc(-c2cccnc2N2CCOCC2)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM368156

NS(=O)(=O)c1c(ccc(-c2ccnc(c2)N2CCNC2=O)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM368013

NS(=O)(=O)c1c(ccc(-c2ccnc3[nH]nnc23)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM262421

NS(=O)(=O)c1c(ccc(-c2ccnc3ccccc23)c1-c1nn[nH]n1)C(F)(F)F

BDBM262423

NS(=O)(=O)c1c(ccc(-c2ccnc3ccccc23)c1-c1nn[nH]n1)C1CC1

BDBM262602

NS(=O)(=O)c1c(ccc(-c2ccnc3ccccc23)c1-c1nn[nH]n1)C1CCCCC1

BDBM262853

NS(=O)(=O)c1c(ccc(-c2cnc(nc2)N2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM367934

NS(=O)(=O)c1c(ccc(-c2cnc(s2)N2CCCC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262855

NS(=O)(=O)c1c(ccc(-c2cnc3[nH]ccc3c2)c1-c1nnn[nH]1)C(F)(F)F

BDBM367829

NS(=O)(=O)c1c(ccc(-c2cnc3cc[nH]c3c2)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM361125

NS(=O)(=O)c1c(ccc(-c2cnc3cc[nH]c3c2)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262622

NS(=O)(=O)c1c(ccc(-c2cnc3cc[nH]c3c2)c1-c1nnn[nH]1)C(F)(F)F

BDBM367911

NS(=O)(=O)c1c(ccc(-c2cnc3ccccc3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367822

NS(=O)(=O)c1c(ccc(-c2cnc3ccccn23)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM367821

NS(=O)(=O)c1c(ccc(-c2cnc3ccccn23)c1-c1nn[nH]n1)S(=O)C1CNC1

BDBM262895

NS(=O)(=O)c1c(ccc(-c2cnc3ccccn23)c1-c1nnn[nH]1)C(F)(F)F

BDBM360984

NS(=O)(=O)c1c(ccc(-c2cnc3ccccn23)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262858

NS(=O)(=O)c1c(ccc(-c2cnc3ccoc3c2)c1-c1nnn[nH]1)C(F)(F)F

BDBM367914

NS(=O)(=O)c1c(ccc(-c2cnc3ccoc3c2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262859

NS(=O)(=O)c1c(ccc(-c2cnc3ncccn23)c1-c1nnn[nH]1)C(F)(F)F

BDBM368114

NS(=O)(=O)c1c(ccc(-c2cncc3[nH]c(=O)[nH]c23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367923

NS(=O)(=O)c1c(ccc(-c2cncnc2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367942

NS(=O)(=O)c1c(ccc(-c2cnn3CCCCc23)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262857

NS(=O)(=O)c1c(ccc(-c2cnn3ccccc23)c1-c1nnn[nH]1)C(F)(F)F

BDBM367933

NS(=O)(=O)c1c(ccc(-c2csc(n2)N2CCCC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM367937

NS(=O)(=O)c1c(ccc(-c2csc(n2)N2CCOCC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262856

NS(=O)(=O)c1c(ccc(-c2snc3ncccc23)c1-c1nnn[nH]1)C(F)(F)F

BDBM367921

NS(=O)(=O)c1c(ccc(C2=CC3C=NNC3N=C2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1 |c:12,17,t:9|

BDBM368031

NS(=O)(=O)c1c(ccc(C2=CCS(=O)(=O)CC2)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1 |t:9|

BDBM262637

NS(=O)(=O)c1c(ccc(C2CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262640

NS(=O)(=O)c1c(ccc(C2CCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262980

NS(=O)(=O)c1c(ccc(C2CCC3(CCNCC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262638

NS(=O)(=O)c1c(ccc(C2CCCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262639

NS(=O)(=O)c1c(ccc(C2CCCCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262657

NS(=O)(=O)c1c(ccc(C2CCCc3sc(nc23)C(O)=O)c1-c1nnn[nH]1)C(F)(F)F

BDBM262982

NS(=O)(=O)c1c(ccc(C2CCN(CC2)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262641

NS(=O)(=O)c1c(ccc(C2CCNc3ccccc23)c1-c1nnn[nH]1)C(F)(F)F

BDBM368035

NS(=O)(=O)c1c(ccc(C2CCOCC2)c1-c1nn[nH]n1)S(=O)(=O)C1CNC1

BDBM262836

NS(=O)(=O)c1c(ccc(C2CC[C@@H](CC2)NC2CCC3(CCNCC3)CC2)c1-c1nnn[nH]1)C(F)(F)F |r,wD:12.15,(8.67,1.13,;7.34,.36,;8.67,-.41,;8.11,1.69,;6,-.41,;6,-1.95,;4.67,-2.72,;3.33,-1.95,;3.33,-.41,;2,.36,;.67,-.41,;-.67,.36,;-.67,1.9,;.67,2.67,;2,1.9,;-2,2.67,;-3.33,1.9,;-4.67,2.67,;-6,1.9,;-6,.36,;-7.34,1.13,;-8.67,.36,;-8.67,-1.18,;-7.34,-1.95,;-6,-1.18,;-4.67,-.41,;-3.33,.36,;4.67,.36,;4.67,1.9,;3.42,2.8,;3.9,4.26,;5.44,4.26,;5.91,2.8,;7.34,-2.72,;8.67,-1.95,;7.34,-4.26,;8.67,-3.49,)|

BDBM262643

NS(=O)(=O)c1c(ccc(C2CC[C@H](O)CC2)c1-c1nnn[nH]1)C(F)(F)F |r,wD:12.12,(3.68,-2.1,;2.35,-2.87,;2.35,-1.33,;3.68,-3.64,;1.95,-4.35,;3.09,-5.43,;2.64,-6.93,;1.15,-7.33,;.07,-6.24,;-1.42,-6.64,;-1.82,-8.13,;-3.31,-8.52,;-4.4,-7.44,;-5.88,-7.83,;-4,-5.95,;-2.51,-5.55,;.46,-4.75,;-.62,-3.66,;-2.16,-3.66,;-2.64,-2.2,;-1.39,-1.29,;-.15,-2.2,;4.58,-5.03,;6.07,-4.63,;4.98,-6.52,;4.66,-3.49,)|

BDBM262644

NS(=O)(=O)c1c(ccc(C2CC[C@H](O)CC2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:12.12,(3.68,-2.1,;2.35,-2.87,;2.35,-1.33,;3.68,-3.64,;1.95,-4.35,;3.09,-5.43,;2.64,-6.93,;1.15,-7.33,;.07,-6.24,;-1.42,-6.64,;-2.51,-5.55,;-4,-5.95,;-4.4,-7.44,;-5.88,-7.83,;-3.31,-8.52,;-1.82,-8.13,;.46,-4.75,;-.62,-3.66,;-2.16,-3.66,;-2.64,-2.2,;-1.39,-1.29,;-.15,-2.2,;4.58,-5.03,;6.07,-4.63,;4.98,-6.52,;4.66,-3.49,)|

BDBM262642

NS(=O)(=O)c1c(ccc(C2CCn3cncc3C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530980

NS(=O)(=O)c1c(ccc(N2CC(C2)N2CCCCC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530979

NS(=O)(=O)c1c(ccc(N2CC(C2)N2CCOCC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262928

NS(=O)(=O)c1c(ccc(N2CC3(C2)CCNCC3)c1-c1nnn[nH]1)C(F)(F)F

BDBM530981

NS(=O)(=O)c1c(ccc(N2CC3(C2)CCNCC3)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262805

NS(=O)(=O)c1c(ccc(N2CC3C(CO)C3C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530930

NS(=O)(=O)c1c(ccc(N2CC3C(CO)C3C2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM262921

NS(=O)(=O)c1c(ccc(N2CCC(C2)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262917

NS(=O)(=O)c1c(ccc(N2CCC(C2)N2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530958

NS(=O)(=O)c1c(ccc(N2CCC(CC2)C(F)F)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262926

NS(=O)(=O)c1c(ccc(N2CCC(CC2)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262927

NS(=O)(=O)c1c(ccc(N2CCC(CC2)N2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530956

NS(=O)(=O)c1c(ccc(N2CCC(CC2)OCCO)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530978

NS(=O)(=O)c1c(ccc(N2CCC(CC2)Oc2ccccn2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531034

NS(=O)(=O)c1c(ccc(N2CCC(CC2)c2c[nH]cn2)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262598

NS(=O)(=O)c1c(ccc(N2CCC(CC2)c2ccc(CO)cc2)c1-c1nn[nH]n1)C(F)(F)F

BDBM530955

NS(=O)(=O)c1c(ccc(N2CCC(CCF)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530949

NS(=O)(=O)c1c(ccc(N2CCC(CCO)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262808

NS(=O)(=O)c1c(ccc(N2CCC(CCO)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530924

NS(=O)(=O)c1c(ccc(N2CCC(CCO)CC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM530957

NS(=O)(=O)c1c(ccc(N2CCC(CF)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530926

NS(=O)(=O)c1c(ccc(N2CCC(CO)CC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM530969

NS(=O)(=O)c1c(ccc(N2CCC(CO)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531025

NS(=O)(=O)c1c(ccc(N2CCC(CO)CC2=O)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530974

NS(=O)(=O)c1c(ccc(N2CCC(Cc3ccccn3)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530959

NS(=O)(=O)c1c(ccc(N2CCC(F)(CO)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530899

NS(=O)(=O)c1c(ccc(N2CCC(O)CC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM530931

NS(=O)(=O)c1c(ccc(N2CCC(O)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531027

NS(=O)(=O)c1c(ccc(N2CCC(O)CC2=O)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262918

NS(=O)(=O)c1c(ccc(N2CCC3(C2)CCNCC3)c1-c1nnn[nH]1)C(F)(F)F

BDBM262923

NS(=O)(=O)c1c(ccc(N2CCC3(CCCNC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262922

NS(=O)(=O)c1c(ccc(N2CCC3(CCNC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262930

NS(=O)(=O)c1c(ccc(N2CCC3(CCNCC3)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530898

NS(=O)(=O)c1c(ccc(N2CCC3(CCNCC3)CC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM530920

NS(=O)(=O)c1c(ccc(N2CCC3(CNC3)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531019

NS(=O)(=O)c1c(ccc(N2CCCC(=O)C2=O)c1[N]1=NNN=N1)S(=O)(=O)N[C@@H]1CCNC1 |r,c:23,t:20|

BDBM530976

NS(=O)(=O)c1c(ccc(N2CCCC(C2)C(=O)NCCCO)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262916

NS(=O)(=O)c1c(ccc(N2CCCC(CCCO)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262807

NS(=O)(=O)c1c(ccc(N2CCCC(CCO)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM262806

NS(=O)(=O)c1c(ccc(N2CCCC(CO)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530925

NS(=O)(=O)c1c(ccc(N2CCCC(CO)C2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM530975

NS(=O)(=O)c1c(ccc(N2CCCC(CO)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531016

NS(=O)(=O)c1c(ccc(N2CCCC(O)C2=O)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262919

NS(=O)(=O)c1c(ccc(N2CCCC3(CCNCC3)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530972

NS(=O)(=O)c1c(ccc(N2CCCCC(O)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531022

NS(=O)(=O)c1c(ccc(N2CCCCC2=O)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530937

NS(=O)(=O)c1c(ccc(N2CCCN(CCO)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531021

NS(=O)(=O)c1c(ccc(N2CCCNC2=O)c1[N]1=NNN=N1)S(=O)(=O)N[C@@H]1CCNC1 |r,c:22,t:19|

BDBM262812

NS(=O)(=O)c1c(ccc(N2CCC[C@@H](O)C2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM262804

NS(=O)(=O)c1c(ccc(N2CCC[C@H](O)C2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM530928

NS(=O)(=O)c1c(ccc(N2CCC[C@H](O)C2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1 |r|

BDBM531020

NS(=O)(=O)c1c(ccc(N2CCC\C(=N\O)C2=O)c1[N]1=NNN=N1)S(=O)(=O)N[C@@H]1CCNC1 |r,c:24,t:21|

BDBM530977

NS(=O)(=O)c1c(ccc(N2CCN(CC2)C(=O)CO)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262811

NS(=O)(=O)c1c(ccc(N2CCN(CCCO)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530921

NS(=O)(=O)c1c(ccc(N2CCN(CCCO)CC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM530961

NS(=O)(=O)c1c(ccc(N2CCN(CCCO)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531030

NS(=O)(=O)c1c(ccc(N2CCN(CCO)CC2)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262906

NS(=O)(=O)c1c(ccc(N2CCN(CCO)CC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530922

NS(=O)(=O)c1c(ccc(N2CCN(CCO)CC2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1

BDBM530966

NS(=O)(=O)c1c(ccc(N2CCN(CCO)CC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262814

NS(=O)(=O)c1c(ccc(N2CCN3C(COC3=O)C2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530995

NS(=O)(=O)c1c(ccc(N2CCNC(CO)CC2)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531059

NS(=O)(=O)c1c(ccc(N2CCNC2=S)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530947

NS(=O)(=O)c1c(ccc(N2CCNCC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530973

NS(=O)(=O)c1c(ccc(N2CCOC(CCO)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530971

NS(=O)(=O)c1c(ccc(N2CCOC(CO)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530938

NS(=O)(=O)c1c(ccc(N2CC[C@@H](CO)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530967

NS(=O)(=O)c1c(ccc(N2CC[C@@H](O)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530964

NS(=O)(=O)c1c(ccc(N2CC[C@H](CO)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262810

NS(=O)(=O)c1c(ccc(N2CC[C@H](CO)[C@H](F)C2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM530929

NS(=O)(=O)c1c(ccc(N2CC[C@H](CO)[C@H](F)C2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1 |r|

BDBM530965

NS(=O)(=O)c1c(ccc(N2CC[C@H](O)C2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262920

NS(=O)(=O)c1c(ccc(N2CC[C@H]3NCCO[C@@H]3C2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM262903

NS(=O)(=O)c1c(ccc(N2C[C@@H](O)[C@H](O)C2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM262813

NS(=O)(=O)c1c(ccc(N2C[C@H](O)C[C@@H](O)C2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM530923

NS(=O)(=O)c1c(ccc(N2C[C@H](O)C[C@@H](O)C2)c1-c1nnn[nH]1)S(=O)(=O)C1CNC1 |r|

BDBM262904

NS(=O)(=O)c1c(ccc(N2C[C@H](O)[C@H](O)C2)c1-c1nnn[nH]1)C(F)(F)F |r|

BDBM262924

NS(=O)(=O)c1c(ccc(NC2(CC2)C2CCNC2)c1-c1nnn[nH]1)C(F)(F)F

BDBM530934

NS(=O)(=O)c1c(ccc(NC2CCOCC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM531051

NS(=O)(=O)c1c(ccc(NCC2CCNCC2)c1-c1nn[nH]n1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530943

NS(=O)(=O)c1c(ccc(NCCN2CCNCC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM530932

NS(=O)(=O)c1c(ccc(NCCN2CCOCC2)c1-c1nnn[nH]1)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262652

NS(=O)(=O)c1c(ccc([C@@H]2CC[C@@H](CC2)C2=NCCN2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,12.15,t:16,(4.86,10.32,;3.53,9.55,;3.53,11.09,;4.86,8.78,;3.13,8.06,;4.27,6.99,;3.82,5.49,;2.33,5.09,;1.25,6.18,;-.24,5.78,;-1.33,6.87,;-2.82,6.47,;-3.22,4.98,;-2.13,3.89,;-.64,4.29,;-4.7,4.58,;-5.95,5.49,;-7.2,4.58,;-6.72,3.12,;-5.18,3.12,;1.64,7.67,;.56,8.76,;-.98,8.76,;-1.46,10.22,;-.21,11.13,;1.03,10.22,;5.76,7.39,;7.25,7.79,;6.16,5.9,;5.84,8.93,)|

BDBM262979

NS(=O)(=O)c1c(ccc([C@H]2CCC(CC2)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F |r,wD:9.8,(5.6,7.15,;4.27,7.92,;5.04,9.26,;4.67,6.43,;2.94,7.15,;2.98,5.58,;1.6,4.84,;.27,5.61,;.27,7.15,;-1.22,7.55,;-2.7,7.13,;-4.19,7.55,;-4.96,6.22,;-3.48,6.64,;-1.99,6.22,;-4.96,4.68,;-6.29,3.91,;-6.29,2.37,;-4.96,1.6,;-3.63,2.37,;-3.63,3.91,;1.6,7.92,;1.6,9.46,;.36,10.37,;.83,11.83,;2.37,11.83,;2.85,10.37,;4.32,4.81,;5.65,4.04,;3.55,3.48,;5.46,5.84,)|

BDBM262653

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)C2=NCCN2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:12.15,wD:9.8,t:16,(4.86,10.32,;3.53,9.55,;3.53,11.09,;4.86,8.78,;3.13,8.06,;4.27,6.99,;3.82,5.49,;2.33,5.09,;1.25,6.18,;-.24,5.78,;-1.33,6.87,;-2.82,6.47,;-3.22,4.98,;-2.13,3.89,;-.64,4.29,;-4.7,4.58,;-5.95,5.49,;-7.2,4.58,;-6.72,3.12,;-5.18,3.12,;1.64,7.67,;.56,8.76,;-.98,8.76,;-1.46,10.22,;-.21,11.13,;1.03,10.22,;5.76,7.39,;7.25,7.79,;6.16,5.9,;5.84,8.93,)|

BDBM262978

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)C2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(5.6,7.15,;4.27,7.92,;5.04,9.26,;4.67,6.43,;2.94,7.15,;2.98,5.58,;1.6,4.84,;.27,5.61,;.27,7.15,;-1.22,7.55,;-1.99,6.22,;-3.48,6.64,;-4.96,6.22,;-4.19,7.55,;-2.7,7.13,;-4.96,4.68,;-6.29,3.91,;-6.29,2.37,;-4.96,1.6,;-3.63,2.37,;-3.63,3.91,;1.6,7.92,;1.6,9.46,;.36,10.37,;.83,11.83,;2.37,11.83,;2.85,10.37,;4.32,4.81,;5.65,4.04,;3.55,3.48,;5.46,5.84,)|

BDBM262832

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CC3(C2)CCNCC3)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(8.28,1.13,;6.94,.36,;8.28,-.41,;7.71,1.69,;5.61,-.41,;5.61,-1.95,;4.28,-2.72,;2.94,-1.95,;2.94,-.41,;1.61,.36,;.28,-.41,;-1.06,.36,;-1.06,1.9,;.28,2.67,;1.61,1.9,;-2.39,2.67,;-3.72,1.9,;-5.21,2.29,;-5.61,.81,;-4.12,.41,;-6.94,1.58,;-8.28,.81,;-8.28,-.73,;-6.94,-1.5,;-5.61,-.73,;4.28,.36,;4.28,1.9,;3.03,2.8,;3.51,4.26,;5.05,4.26,;5.52,2.8,;6.94,-2.72,;8.28,-1.95,;6.94,-4.26,;8.28,-3.49,)|

BDBM262833

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CC3CNCCN3C2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(8.38,1.13,;7.04,.36,;8.38,-.41,;7.81,1.69,;5.71,-.41,;5.71,-1.95,;4.37,-2.72,;3.04,-1.95,;3.04,-.41,;1.71,.36,;.37,-.41,;-.96,.36,;-.96,1.9,;.37,2.67,;1.71,1.9,;-2.29,2.67,;-3.63,1.9,;-3.79,.36,;-5.3,.04,;-6.07,-1.29,;-7.61,-1.29,;-8.38,.04,;-7.61,1.38,;-6.07,1.38,;-5.03,2.52,;4.37,.36,;4.37,1.9,;3.13,2.8,;3.6,4.26,;5.14,4.26,;5.62,2.8,;7.04,-2.72,;8.38,-1.95,;7.04,-4.26,;8.38,-3.49,)|

BDBM262844

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CCCNC2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(7.34,1.13,;6,.36,;7.34,-.41,;6.77,1.69,;4.67,-.41,;4.67,-1.95,;3.33,-2.72,;2,-1.95,;2,-.41,;.67,.36,;-.67,-.41,;-2,.36,;-2,1.9,;-.67,2.67,;.67,1.9,;-3.33,2.67,;-4.67,1.9,;-6,2.67,;-7.34,1.9,;-7.34,.36,;-6,-.41,;-4.67,.36,;3.33,.36,;3.33,1.9,;2.09,2.8,;2.56,4.26,;4.1,4.26,;4.58,2.8,;6,-2.72,;7.34,-1.95,;6,-4.26,;7.34,-3.49,)|

BDBM262842

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CCCNCC2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(7.69,1.13,;6.35,.36,;7.69,-.41,;7.12,1.69,;5.02,-.41,;5.02,-1.95,;3.69,-2.72,;2.35,-1.95,;2.35,-.41,;1.02,.36,;-.31,-.41,;-1.65,.36,;-1.65,1.9,;-.31,2.67,;1.02,1.9,;-2.98,2.67,;-4.31,1.9,;-5.52,2.86,;-7.02,2.51,;-7.69,1.13,;-7.02,-.26,;-5.52,-.61,;-4.31,.36,;3.69,.36,;3.69,1.9,;2.44,2.8,;2.92,4.26,;4.46,4.26,;4.93,2.8,;6.35,-2.72,;7.69,-1.95,;6.35,-4.26,;7.69,-3.49,)|

BDBM262843

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CCNC2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(7.19,1.13,;5.85,.36,;7.19,-.41,;6.62,1.69,;4.52,-.41,;4.52,-1.95,;3.19,-2.72,;1.85,-1.95,;1.85,-.41,;.52,.36,;-.82,-.41,;-2.15,.36,;-2.15,1.9,;-.82,2.67,;.52,1.9,;-3.48,2.67,;-4.82,1.9,;-4.82,.36,;-6.28,-.12,;-7.19,1.13,;-6.28,2.37,;3.19,.36,;3.19,1.9,;1.94,2.8,;2.42,4.26,;3.96,4.26,;4.43,2.8,;5.85,-2.72,;7.19,-1.95,;5.85,-4.26,;7.19,-3.49,)|

BDBM262845

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(7.34,1.13,;6,.36,;7.34,-.41,;6.77,1.69,;4.67,-.41,;4.67,-1.95,;3.33,-2.72,;2,-1.95,;2,-.41,;.67,.36,;-.67,-.41,;-2,.36,;-2,1.9,;-.67,2.67,;.67,1.9,;-3.33,2.67,;-4.67,1.9,;-6,2.67,;-7.34,1.9,;-7.34,.36,;-6,-.41,;-4.67,.36,;3.33,.36,;3.33,1.9,;2.09,2.8,;2.56,4.26,;4.1,4.26,;4.58,2.8,;6,-2.72,;7.34,-1.95,;6,-4.26,;7.34,-3.49,)|

BDBM262831

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CC[C@@H]3CNCC[C@H]3C2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,24.26,wD:12.15,19.19,(8.67,1.13,;7.34,.36,;8.67,-.41,;8.11,1.69,;6,-.41,;6,-1.95,;4.67,-2.72,;3.33,-1.95,;3.33,-.41,;2,.36,;.67,-.41,;-.67,.36,;-.67,1.9,;.67,2.67,;2,1.9,;-2,2.67,;-3.33,1.9,;-3.33,.36,;-4.67,-.41,;-6,.36,;-7.34,-.41,;-8.67,.36,;-8.67,1.9,;-7.34,2.67,;-6,1.9,;-4.67,2.67,;4.67,.36,;4.67,1.9,;3.42,2.8,;3.9,4.26,;5.44,4.26,;5.91,2.8,;7.34,-2.72,;8.67,-1.95,;7.34,-4.26,;8.67,-3.49,)|

BDBM262826

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CC[C@H]3CCN[C@H]3C2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:23.23,19.20,9.8,wD:12.15,(8.52,1.13,;7.19,.36,;8.52,-.41,;7.96,1.69,;5.85,-.41,;5.85,-1.95,;4.52,-2.72,;3.19,-1.95,;3.19,-.41,;1.85,.36,;.52,-.41,;-.82,.36,;-.82,1.9,;.52,2.67,;1.85,1.9,;-2.15,2.67,;-3.48,1.9,;-3.48,.36,;-4.82,-.41,;-6.15,.36,;-7.61,-.12,;-8.52,1.13,;-7.61,2.37,;-6.15,1.9,;-4.82,2.67,;4.52,.36,;4.52,1.9,;3.27,2.8,;3.75,4.26,;5.29,4.26,;5.77,2.8,;7.19,-2.72,;8.52,-1.95,;7.19,-4.26,;8.52,-3.49,)|

BDBM262839

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NC2CC[C@H]3NCC[C@@H]23)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,19.20,23.23,(7.19,1.13,;5.85,.36,;7.19,-.41,;6.62,1.69,;4.52,-.41,;4.52,-1.95,;3.19,-2.72,;1.85,-1.95,;1.85,-.41,;.52,.36,;-.82,-.41,;-2.15,.36,;-2.15,1.9,;-.82,2.67,;.52,1.9,;-3.48,2.67,;-4.82,1.9,;-6.28,2.37,;-7.19,1.13,;-6.28,-.12,;-6.28,-1.66,;-4.82,-2.14,;-3.91,-.89,;-4.82,.36,;3.19,.36,;3.19,1.9,;1.94,2.8,;2.42,4.26,;3.96,4.26,;4.43,2.8,;5.85,-2.72,;7.19,-1.95,;5.85,-4.26,;7.19,-3.49,)|

BDBM262828

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NCC2CCCN2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(6.62,1.13,;5.29,.36,;6.62,-.41,;6.06,1.69,;3.96,-.41,;3.96,-1.95,;2.62,-2.72,;1.29,-1.95,;1.29,-.41,;-.04,.36,;-1.38,-.41,;-2.71,.36,;-2.71,1.9,;-1.38,2.67,;-.04,1.9,;-4.04,2.67,;-5.38,1.9,;-5.38,.36,;-6.62,-.55,;-6.15,-2.01,;-4.61,-2.01,;-4.13,-.55,;2.62,.36,;2.62,1.9,;1.38,2.8,;1.85,4.26,;3.39,4.26,;3.87,2.8,;5.29,-2.72,;6.62,-1.95,;5.29,-4.26,;6.62,-3.49,)|

BDBM262827

NS(=O)(=O)c1c(ccc([C@H]2CC[C@@H](CC2)NCC2CCNCC2)c1-c1nnn[nH]1)C(F)(F)F |r,wU:9.8,wD:12.15,(8,.77,;6.67,,;8,-.77,;7.44,1.33,;5.33,-.77,;5.33,-2.31,;4,-3.08,;2.67,-2.31,;2.67,-.77,;1.33,,;,-.77,;-1.33,,;-1.33,1.54,;,2.31,;1.33,1.54,;-2.67,2.31,;-4,1.54,;-5.33,2.31,;-5.33,3.85,;-6.67,4.62,;-8,3.85,;-8,2.31,;-6.67,1.54,;4,,;4,1.54,;2.76,2.45,;3.23,3.91,;4.77,3.91,;5.25,2.45,;6.67,-3.08,;8,-2.31,;6.67,-4.62,;8,-3.85,)|

BDBM262437

NS(=O)(=O)c1cc(Cl)cc(-c2ccc3CNC(=O)c3c2)c1-c1nn[nH]n1

BDBM360852

NS(=O)(=O)c1ccc(-c2cccc3[nH]c(nc23)C(O)=O)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM360363

NS(=O)(=O)c1ccc(-c2cccc3cn[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM531002

NS(=O)(=O)c1ccc(N2CCC3(CCNCC3)C2=O)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262402

NS(=O)(=O)c1ccc(O)cc1-c1nn[nH]n1

BDBM360979

NS(=O)(=O)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262212

NS(=O)(=O)c1ccc(cc1)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262547

NS(=O)(=O)c1ccc2ccccc2c1-c1nnn[nH]1

BDBM262255

NS(=O)(=O)c1cccc(-c2c[nH]c3nccnc23)c1-c1nn[nH]n1

BDBM262277

NS(=O)(=O)c1cccc(-c2cc(F)cc(F)c2)c1-c1nnn[nH]1

BDBM262558

NS(=O)(=O)c1cccc(-c2cc3ccncc3s2)c1-c1nnn[nH]1

BDBM262559

NS(=O)(=O)c1cccc(-c2cc3cnccc3s2)c1-c1nnn[nH]1

BDBM262227

NS(=O)(=O)c1cccc(-c2ccc(CC3OC(=O)NC3=O)cc2)c1-c1nn[nH]n1

BDBM262520

NS(=O)(=O)c1cccc(-c2ccc(CN3CC(F)(F)C3)cc2)c1-c1nnn[nH]1

BDBM262544

NS(=O)(=O)c1cccc(-c2ccc(CN3CC(O)C(F)C3)cc2)c1-c1nnn[nH]1

BDBM262491

NS(=O)(=O)c1cccc(-c2ccc(CN3CCC(C3)C(O)=O)cc2)c1-c1nnn[nH]1

BDBM262541

NS(=O)(=O)c1cccc(-c2ccc(CN3CCC(CCO)C3)cc2)c1-c1nnn[nH]1

BDBM262542

NS(=O)(=O)c1cccc(-c2ccc(CN3CCC(O)CC3)cc2)c1-c1nnn[nH]1

BDBM262526

NS(=O)(=O)c1cccc(-c2ccc(CN3CCC3C(O)=O)cc2)c1-c1nnn[nH]1

BDBM262543

NS(=O)(=O)c1cccc(-c2ccc(CN3CCCC3CO)cc2)c1-c1nnn[nH]1

BDBM262534

NS(=O)(=O)c1cccc(-c2ccc(CN3CCNC(=O)C3)cc2)c1-c1nnn[nH]1

BDBM262489

NS(=O)(=O)c1cccc(-c2ccc(CN3CCOCC3)cc2)c1-c1nnn[nH]1

BDBM262539

NS(=O)(=O)c1cccc(-c2ccc(CN3CC[C@@H](CO)C3)cc2)c1-c1nnn[nH]1 |r|

BDBM262540

NS(=O)(=O)c1cccc(-c2ccc(CN3CC[C@H](CO)C3)cc2)c1-c1nnn[nH]1 |r|

BDBM262490

NS(=O)(=O)c1cccc(-c2ccc(CN3CNC(=O)C3)cc2)c1-c1nnn[nH]1

BDBM262535

NS(=O)(=O)c1cccc(-c2ccc(CN3C[C@H](O)C[C@H]3CO)cc2)c1-c1nnn[nH]1 |r|

BDBM262522

NS(=O)(=O)c1cccc(-c2ccc(CNC(CO)CO)cc2)c1-c1nnn[nH]1

BDBM262487

NS(=O)(=O)c1cccc(-c2ccc(CNC3CC(F)(F)C3)cc2)c1-c1nnn[nH]1

BDBM262523

NS(=O)(=O)c1cccc(-c2ccc(CNC3CCC(=O)NC3)cc2)c1-c1nnn[nH]1

BDBM262527

NS(=O)(=O)c1cccc(-c2ccc(CNC3CCN(CC3)C3CCCC3)cc2)c1-c1nnn[nH]1

BDBM262536

NS(=O)(=O)c1cccc(-c2ccc(CNC3CCNC3=O)cc2)c1-c1nnn[nH]1

BDBM262478

NS(=O)(=O)c1cccc(-c2ccc(CNCC(=O)NO)cc2)c1-c1nnn[nH]1

BDBM262528

NS(=O)(=O)c1cccc(-c2ccc(CNCC3(O)CC3)cc2)c1-c1nnn[nH]1

BDBM262524

NS(=O)(=O)c1cccc(-c2ccc(CNCC3(O)CCC3)cc2)c1-c1nnn[nH]1

BDBM262476

NS(=O)(=O)c1cccc(-c2ccc(CNCCN3CCCC3)cc2)c1-c1nn[nH]n1

BDBM262538

NS(=O)(=O)c1cccc(-c2ccc(CNCCO)cc2)c1-c1nnn[nH]1

BDBM262532

NS(=O)(=O)c1cccc(-c2ccc(CNCCc3c[nH]cn3)cc2)c1-c1nnn[nH]1

BDBM262537

NS(=O)(=O)c1cccc(-c2ccc(CNCCc3cc[nH]n3)cc2)c1-c1nnn[nH]1

BDBM262533

NS(=O)(=O)c1cccc(-c2ccc(CNCCc3cn[nH]c3)cc2)c1-c1nnn[nH]1

BDBM262486

NS(=O)(=O)c1cccc(-c2ccc(CNCCc3nc[nH]n3)cc2)c1-c1nnn[nH]1

BDBM262530

NS(=O)(=O)c1cccc(-c2ccc(CNCCc3ncc[nH]3)cc2)c1-c1nnn[nH]1

BDBM262498

NS(=O)(=O)c1cccc(-c2ccc(CNCCn3ccnn3)cc2)c1-c1nnn[nH]1

BDBM262531

NS(=O)(=O)c1cccc(-c2ccc(CNCCn3nccn3)cc2)c1-c1nnn[nH]1

BDBM262521

NS(=O)(=O)c1cccc(-c2ccc(CNC[C@@]3(O)CCOC3)cc2)c1-c1nnn[nH]1 |r|

BDBM262525

NS(=O)(=O)c1cccc(-c2ccc(CNCc3ccncn3)cc2)c1-c1nnn[nH]1

BDBM262529

NS(=O)(=O)c1cccc(-c2ccc(CNCc3nn[nH]n3)cc2)c1-c1nnn[nH]1

BDBM262517

NS(=O)(=O)c1cccc(-c2ccc(CN[C@@H]3CC[C@H](O)C3)cc2)c1-c1nnn[nH]1 |r|

BDBM262513

NS(=O)(=O)c1cccc(-c2ccc(CN[C@H]3COC[C@@H]3O)cc2)c1-c1nnn[nH]1 |r|

BDBM262177

NS(=O)(=O)c1cccc(-c2ccc(CO)cc2)c1-c1nnn[nH]1

BDBM262406

NS(=O)(=O)c1cccc(-c2ccc(CO)nc2)c1-c1nnn[nH]1

BDBM262199

NS(=O)(=O)c1cccc(-c2ccc(F)nc2)c1-c1nn[nH]n1

BDBM262775

NS(=O)(=O)c1cccc(-c2ccc(NC3CCNC3)nc2)c1-c1nnn[nH]1

BDBM262785

NS(=O)(=O)c1cccc(-c2ccc(NCC3CCN3)nc2)c1-c1nnn[nH]1

BDBM262574

NS(=O)(=O)c1cccc(-c2ccc(NCCO)nc2)c1-c1nn[nH]n1

BDBM262231

NS(=O)(=O)c1cccc(-c2ccc(O)nc2)c1-c1nn[nH]n1

BDBM262464

NS(=O)(=O)c1cccc(-c2ccc(OC3CCNCC3)cc2)c1-c1nnn[nH]1

BDBM262240

NS(=O)(=O)c1cccc(-c2ccc(OCCN3CCCCC3)cc2)c1-c1nn[nH]n1

BDBM262201

NS(=O)(=O)c1cccc(-c2ccc(cc2)-c2ccn[nH]2)c1-c1nn[nH]n1

BDBM262223

NS(=O)(=O)c1cccc(-c2ccc(cc2)-c2nnn[nH]2)c1-c1nn[nH]n1

BDBM262398

NS(=O)(=O)c1cccc(-c2ccc(cc2)-c2noc(n2)C2CCNC2)c1-c1nn[nH]n1

BDBM262456

NS(=O)(=O)c1cccc(-c2ccc(cc2)C#N)c1-c1nnn[nH]1

BDBM262203

NS(=O)(=O)c1cccc(-c2ccc(cc2)C(=O)N2CCC(O)CC2)c1-c1nn[nH]n1

BDBM262159

NS(=O)(=O)c1cccc(-c2ccc(cc2)C(=O)N2CCOCC2)c1-c1nn[nH]n1

BDBM262160

NS(=O)(=O)c1cccc(-c2ccc(cc2)C(=O)NC2CC2)c1-c1nn[nH]n1

BDBM262092

NS(=O)(=O)c1cccc(-c2ccc(cc2)C(=O)NC2CCOC2)c1-c1nn[nH]n1

BDBM262168

NS(=O)(=O)c1cccc(-c2ccc(cc2)C(=O)NCCO)c1-c1nn[nH]n1

BDBM262152

NS(=O)(=O)c1cccc(-c2ccc(cc2)C(O)C(F)(F)F)c1-c1nn[nH]n1

BDBM262175

NS(=O)(=O)c1cccc(-c2ccc(cc2)C(O)C(F)F)c1-c1nnn[nH]1

BDBM262469

NS(=O)(=O)c1cccc(-c2ccc(cc2)C(O)CO)c1-c1nn[nH]n1

BDBM262176

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2(CCOCC2)C#N)c1-c1nnn[nH]1

BDBM262432

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2(O)CCNC2)c1-c1nn[nH]n1

BDBM262463

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2(O)CNC2)c1-c1nn[nH]n1

BDBM262433

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2=CCNC2)c1-c1nn[nH]n1 |t:16|

BDBM262765

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2CCN(CC3CCNC3)CC2)c1-c1nnn[nH]1

BDBM262764

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2CCN(CC3CNC3)CC2)c1-c1nnn[nH]1

BDBM262766

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2CCN(C[C@H]3CNCCO3)CC2)c1-c1nnn[nH]1 |r|

BDBM262328

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2CCNC2)c1-c1nnn[nH]1

BDBM262178

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2CCNC2=O)c1-c1nnn[nH]1

BDBM262182

NS(=O)(=O)c1cccc(-c2ccc(cc2)C2CCNCC2)c1-c1nn[nH]n1

BDBM262169

NS(=O)(=O)c1cccc(-c2ccc(cc2)N2CCCCC2)c1-c1nn[nH]n1

BDBM262161

NS(=O)(=O)c1cccc(-c2ccc(cc2)N2CCOCC2)c1-c1nn[nH]n1

BDBM262211

NS(=O)(=O)c1cccc(-c2ccc(cc2)S(=O)(=O)NC2CC2)c1-c1nn[nH]n1

BDBM262265

NS(=O)(=O)c1cccc(-c2ccc(nc2)-n2cccn2)c1-c1nnn[nH]1

BDBM262173

NS(=O)(=O)c1cccc(-c2ccc(nc2)C2(OCCO2)C(F)(F)F)c1-c1nn[nH]n1

BDBM262777

NS(=O)(=O)c1cccc(-c2ccc(nc2)N2CC(CN3CCCC3)C2)c1-c1nnn[nH]1

BDBM262769

NS(=O)(=O)c1cccc(-c2ccc(nc2)N2CCC(CO)C2)c1-c1nnn[nH]1

BDBM262780

NS(=O)(=O)c1cccc(-c2ccc(nc2)N2CCC(O)C2)c1-c1nnn[nH]1

BDBM262470

NS(=O)(=O)c1cccc(-c2ccc(nc2)N2CCCCC2)c1-c1nn[nH]n1

BDBM262472

NS(=O)(=O)c1cccc(-c2ccc(nc2)N2CCNCC2)c1-c1nn[nH]n1

BDBM262471

NS(=O)(=O)c1cccc(-c2ccc(nc2)N2CCOCC2)c1-c1nn[nH]n1

BDBM262783

NS(=O)(=O)c1cccc(-c2ccc(nc2)N2CC[C@@H]2CO)c1-c1nnn[nH]1 |r|

BDBM262204

NS(=O)(=O)c1cccc(-c2ccc3CNC(=O)c3c2)c1-c1nn[nH]n1

BDBM262236

NS(=O)(=O)c1cccc(-c2ccc3OCCCc3c2)c1-c1nn[nH]n1

BDBM262207

NS(=O)(=O)c1cccc(-c2ccc3OCCOc3c2)c1-c1nn[nH]n1

BDBM262235

NS(=O)(=O)c1cccc(-c2ccc3[nH]c(=O)[nH]c3c2)c1-c1nn[nH]n1

BDBM262461

NS(=O)(=O)c1cccc(-c2ccc3[nH]ncc3c2)c1-c1nn[nH]n1

BDBM262225

NS(=O)(=O)c1cccc(-c2ccc3[nH]nnc3c2)c1-c1nn[nH]n1

BDBM262220

NS(=O)(=O)c1cccc(-c2ccc3c(c2)[nH]cnc3=O)c1-c1nn[nH]n1

BDBM262222

NS(=O)(=O)c1cccc(-c2ccc3ccncc3c2)c1-c1nn[nH]n1

BDBM262241

NS(=O)(=O)c1cccc(-c2ccc3cn[nH]c3c2)c1-c1nn[nH]n1

BDBM262556

NS(=O)(=O)c1cccc(-c2ccc3cnccc3c2)c1-c1nnn[nH]1

BDBM262435

NS(=O)(=O)c1cccc(-c2ccc3nc(ccc3c2)C(O)=O)c1-c1nn[nH]n1

BDBM262217

NS(=O)(=O)c1cccc(-c2ccc3ncccc3c2)c1-c1nn[nH]n1

BDBM262466

NS(=O)(=O)c1cccc(-c2ccc3nccn3c2)c1-c1nn[nH]n1

BDBM262553

NS(=O)(=O)c1cccc(-c2ccc3nccnc3c2)c1-c1nnn[nH]1

BDBM262278

NS(=O)(=O)c1cccc(-c2ccc3nonc3c2)c1-c1nnn[nH]1

BDBM262267

NS(=O)(=O)c1cccc(-c2cccc(CO)c2)c1-c1nnn[nH]1

BDBM262187

NS(=O)(=O)c1cccc(-c2cccc(F)n2)c1-c1nn[nH]n1

BDBM262221

NS(=O)(=O)c1cccc(-c2cccc(c2)-n2nccn2)c1-c1nn[nH]n1

BDBM262668

NS(=O)(=O)c1cccc(-c2cccc3C(=O)COc23)c1-c1nn[nH]n1

BDBM262268

NS(=O)(=O)c1cccc(-c2cccc3C(=O)NCc23)c1-c1nnn[nH]1

BDBM262269

NS(=O)(=O)c1cccc(-c2cccc3CCCNc23)c1-c1nnn[nH]1

BDBM262669

NS(=O)(=O)c1cccc(-c2cccc3ccoc23)c1-c1nn[nH]n1

BDBM262569

NS(=O)(=O)c1cccc(-c2cccc3sc(Br)nc23)c1-c1nnn[nH]1

BDBM262793

NS(=O)(=O)c1cccc(-c2cccc3sc(NC4CCN(CCF)CC4)nc23)c1-c1nnn[nH]1

BDBM262570

NS(=O)(=O)c1cccc(-c2cccc3scnc23)c1-c1nnn[nH]1

BDBM262164

NS(=O)(=O)c1cccc(-c2ccccc2)c1-c1nn[nH]n1

BDBM262474

NS(=O)(=O)c1cccc(-c2ccccc2O)c1-c1nn[nH]n1

BDBM262244

NS(=O)(=O)c1cccc(-c2ccccn2)c1-c1nn[nH]n1

BDBM262170

NS(=O)(=O)c1cccc(-c2cccnc2)c1-c1nn[nH]n1

BDBM262192

NS(=O)(=O)c1cccc(-c2ccco2)c1-c1nn[nH]n1

BDBM262171

NS(=O)(=O)c1cccc(-c2cccs2)c1-c1nn[nH]n1

BDBM262395

NS(=O)(=O)c1cccc(-c2ccn3cncc3c2)c1-c1nn[nH]n1

BDBM262243

NS(=O)(=O)c1cccc(-c2ccnc(CO)c2)c1-c1nn[nH]n1

BDBM262197

NS(=O)(=O)c1cccc(-c2ccnc(F)c2)c1-c1nn[nH]n1

BDBM262467

NS(=O)(=O)c1cccc(-c2ccnc3ccccc23)c1-c1nn[nH]n1

BDBM262554

NS(=O)(=O)c1cccc(-c2ccnc3ncccc23)c1-c1nnn[nH]1

BDBM262246

NS(=O)(=O)c1cccc(-c2ccnn2Cc2ccccc2)c1-c1nn[nH]n1

BDBM262198

NS(=O)(=O)c1cccc(-c2ccnnc2)c1-c1nn[nH]n1

BDBM262260

NS(=O)(=O)c1cccc(-c2cn(c3ncccc23)S(=O)(=O)c2ccccc2)c1-c1nn[nH]n1

BDBM262271

NS(=O)(=O)c1cccc(-c2cnc(NC3CC3)nc2)c1-c1nnn[nH]1

BDBM262272

NS(=O)(=O)c1cccc(-c2cnc(NC3CCCC3)nc2)c1-c1nnn[nH]1

BDBM262273

NS(=O)(=O)c1cccc(-c2cnc(NCCO)nc2)c1-c1nnn[nH]1

BDBM262270

NS(=O)(=O)c1cccc(-c2cnc(nc2)N2CCCCC2)c1-c1nnn[nH]1

BDBM262468

NS(=O)(=O)c1cccc(-c2cnc(nc2)N2CCNCC2)c1-c1nn[nH]n1

BDBM262245

NS(=O)(=O)c1cccc(-c2cnc(nc2)N2CCOCC2)c1-c1nn[nH]n1

BDBM262172

NS(=O)(=O)c1cccc(-c2cnc(s2)C2(O)CCC2)c1-c1nn[nH]n1

BDBM262567

NS(=O)(=O)c1cccc(-c2cnc3CCCCn23)c1-c1nnn[nH]1

BDBM262460

NS(=O)(=O)c1cccc(-c2cnc3[nH]ccc3c2)c1-c1nn[nH]n1

BDBM262457

NS(=O)(=O)c1cccc(-c2cnc3[nH]ncc3c2)c1-c1nn[nH]n1

BDBM262458

NS(=O)(=O)c1cccc(-c2cnc3cc[nH]c3c2)c1-c1nn[nH]n1

BDBM262799

NS(=O)(=O)c1cccc(-c2cnc3ccc(Cl)nn23)c1-c1nnn[nH]1

BDBM262795

NS(=O)(=O)c1cccc(-c2cnc3ccc(cn23)C#N)c1-c1nnn[nH]1

BDBM262796

NS(=O)(=O)c1cccc(-c2cnc3cccc(C#N)n23)c1-c1nnn[nH]1

BDBM262313

NS(=O)(=O)c1cccc(-c2cnc3ccccc3c2)c1-c1nnn[nH]1

BDBM262552

NS(=O)(=O)c1cccc(-c2cnc3ccccn23)c1-c1nnn[nH]1

BDBM262459

NS(=O)(=O)c1cccc(-c2cnc3ccoc3c2)c1-c1nn[nH]n1

BDBM262798

NS(=O)(=O)c1cccc(-c2cnc3cnccn23)c1-c1nnn[nH]1

BDBM262797

NS(=O)(=O)c1cccc(-c2cnc3nc(ccn23)C(F)(F)F)c1-c1nnn[nH]1

BDBM262794

NS(=O)(=O)c1cccc(-c2cnc3ncccn23)c1-c1nnn[nH]1

BDBM262234

NS(=O)(=O)c1cccc(-c2cncc(F)c2)c1-c1nn[nH]n1

BDBM262284

NS(=O)(=O)c1cccc(-c2cncc(c2)C#N)c1-c1nnn[nH]1

BDBM262193

NS(=O)(=O)c1cccc(-c2cncnc2)c1-c1nn[nH]n1

BDBM262195

NS(=O)(=O)c1cccc(-c2cncs2)c1-c1nn[nH]n1

BDBM262274

NS(=O)(=O)c1cccc(-c2cnn(CCN3CCOCC3)c2)c1-c1nnn[nH]1

BDBM262252

NS(=O)(=O)c1cccc(-c2cnn(Cc3ccccn3)c2)c1-c1nn[nH]n1

BDBM262251

NS(=O)(=O)c1cccc(-c2cnn(Cc3ccncc3)c2)c1-c1nn[nH]n1

BDBM262258

NS(=O)(=O)c1cccc(-c2cnn3CCCCc23)c1-c1nn[nH]n1

BDBM262249

NS(=O)(=O)c1cccc(-c2cnn3ccccc23)c1-c1nn[nH]n1

BDBM262256

NS(=O)(=O)c1cccc(-c2cnn3ncccc23)c1-c1nn[nH]n1

BDBM262254

NS(=O)(=O)c1cccc(-c2csc(CN3CCOCC3)c2)c1-c1nn[nH]n1

BDBM262557

NS(=O)(=O)c1cccc(-c2csc(n2)-c2ccncc2)c1-c1nnn[nH]1

BDBM262247

NS(=O)(=O)c1cccc(-c2csc3ccccc23)c1-c1nn[nH]n1

BDBM262196

NS(=O)(=O)c1cccc(-c2cscn2)c1-c1nn[nH]n1

BDBM262555

NS(=O)(=O)c1cccc(-c2nc(cs2)-c2ccncc2)c1-c1nnn[nH]1

BDBM262190

NS(=O)(=O)c1cccc(-c2ncccn2)c1-c1nn[nH]n1

BDBM262186

NS(=O)(=O)c1cccc(-c2nccs2)c1-c1nn[nH]n1

BDBM262562

NS(=O)(=O)c1cccc(-c2snc3cccnc23)c1-c1nnn[nH]1

BDBM262561

NS(=O)(=O)c1cccc(-c2snc3ncccc23)c1-c1nnn[nH]1

BDBM262293

NS(=O)(=O)c1cccc(C#CCC2CNCCO2)c1-c1nn[nH]n1

BDBM262294

NS(=O)(=O)c1cccc(C#CCN2CCC(=O)CC2)c1-c1nn[nH]n1

BDBM262296

NS(=O)(=O)c1cccc(C#CCN2CCS(=O)(=O)CC2)c1-c1nn[nH]n1

BDBM262295

NS(=O)(=O)c1cccc(C#Cc2cccnc2)c1-c1nn[nH]n1

BDBM262445

NS(=O)(=O)c1cccc(C(O)=O)c1-c1nn[nH]n1

BDBM262215

NS(=O)(=O)c1cccc(C2=CCC(CC2)C#N)c1-c1nn[nH]n1 |t:9|

BDBM262214

NS(=O)(=O)c1cccc(C2=CCCOC2)c1-c1nn[nH]n1 |t:9|

BDBM262288

NS(=O)(=O)c1cccc(C2=CCOCC2)c1-c1nnn[nH]1 |t:9|

BDBM262289

NS(=O)(=O)c1cccc(C2=CCS(=O)(=O)CC2)c1-c1nnn[nH]1 |t:9|

BDBM262213

NS(=O)(=O)c1cccc(C2=CCSCC2)c1-c1nn[nH]n1 |t:9|

BDBM262305

NS(=O)(=O)c1cccc(C2CC2)c1-c1nnn[nH]1

BDBM262318

NS(=O)(=O)c1cccc(C2CCC(CC2)N2CCNCC2)c1-c1nn[nH]n1 |(5.26,4.17,;4.86,2.68,;3.77,3.77,;6.35,3.08,;4.46,1.2,;5.55,.11,;5.15,-1.38,;3.67,-1.78,;2.58,-.69,;1.09,-1.09,;;-1.49,-.4,;-1.89,-1.89,;-.8,-2.98,;.69,-2.58,;-3.37,-2.28,;-4.46,-1.2,;-5.95,-1.59,;-6.35,-3.08,;-5.26,-4.17,;-3.77,-3.77,;2.98,.8,;1.89,1.89,;1.89,3.43,;.42,3.9,;-.48,2.66,;.42,1.41,)|

BDBM262319

NS(=O)(=O)c1cccc(C2CCC(O)CC2)c1-c1nn[nH]n1 |(3.77,3.57,;3.37,2.09,;2.28,3.17,;4.86,2.48,;2.98,.6,;4.06,-.49,;3.67,-1.98,;2.18,-2.38,;1.09,-1.29,;-.4,-1.69,;-1.49,-.6,;-2.98,-1,;-3.37,-2.48,;-4.86,-2.88,;-2.28,-3.57,;-.8,-3.17,;1.49,.2,;.4,1.29,;.4,2.83,;-1.07,3.3,;-1.97,2.06,;-1.07,.81,)|

BDBM262297

NS(=O)(=O)c1cccc(C2CCC2)c1-c1nnn[nH]1

BDBM262308

NS(=O)(=O)c1cccc(C2CCCC2)c1-c1nnn[nH]1

BDBM262299

NS(=O)(=O)c1cccc(C2CCCCC2)c1-c1nnn[nH]1

BDBM262325

NS(=O)(=O)c1cccc(C2CCCN(C2)C(=O)C2CC2)c1-c1nn[nH]n1

BDBM262323

NS(=O)(=O)c1cccc(C2CCCNC2)c1-c1nn[nH]n1

BDBM262666

NS(=O)(=O)c1cccc(C2CCCc3ncccc23)c1-c1nn[nH]n1

BDBM262324

NS(=O)(=O)c1cccc(C2CCN(CC2)C(=O)C2(CC2)c2ccccc2)c1-c1nn[nH]n1

BDBM262326

NS(=O)(=O)c1cccc(C2CCn3cncc3C2)c1-c1nn[nH]n1

BDBM262250

NS(=O)(=O)c1cccc(C2Cc3cc(ccc3N2)C#N)c1-c1nn[nH]n1

BDBM262301

NS(=O)(=O)c1cccc(CC2CCCCC2)c1-c1nnn[nH]1

BDBM262312

NS(=O)(=O)c1cccc(CCC2CCCCC2)c1-c1nnn[nH]1

BDBM262302

NS(=O)(=O)c1cccc(CCc2ccccc2)c1-c1nnn[nH]1

BDBM262292

NS(=O)(=O)c1cccc(CCc2ccccn2)c1-c1nnn[nH]1

BDBM262291

NS(=O)(=O)c1cccc(CCc2cccnc2)c1-c1nnn[nH]1

BDBM262290

NS(=O)(=O)c1cccc(COc2ccccc2)c1-c1nnn[nH]1

BDBM262300

NS(=O)(=O)c1cccc(Cc2cccc(c2)C#N)c1-c1nnn[nH]1

BDBM262310

NS(=O)(=O)c1cccc(Cc2ccccc2)c1-c1nnn[nH]1

BDBM262314

NS(=O)(=O)c1cccc(Cc2ccccc2C#N)c1-c1nnn[nH]1

BDBM262266

NS(=O)(=O)c1cccc(c1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262404

NS(=O)(=O)c1cccc(c1-c1nnn[nH]1)C(F)(F)F

BDBM262336

NS(=O)(=O)c1ccnc(-c2ccc(CO)cc2)c1-c1nnn[nH]1

BDBM262337

NS(=O)(=O)c1cncc(-c2ccc(CO)cc2)c1-c1nnn[nH]1

BDBM262329

NS(=O)(=O)c1nccc(-c2ccc(CO)cc2)c1-c1nnn[nH]1

BDBM262343

NS(=O)(=O)c1nccc(-c2ccc(CO)nc2)c1-c1nnn[nH]1

BDBM262333

NS(=O)(=O)c1nccc(-c2ccc(cc2)C(=O)NC2CC2)c1-c1nnn[nH]1

BDBM262334

NS(=O)(=O)c1nccc(-c2ccc(cc2)C(=O)NC2CCOCC2)c1-c1nnn[nH]1

BDBM262331

NS(=O)(=O)c1nccc(-c2ccc(cc2)C(O)=O)c1-c1nnn[nH]1

BDBM262346

NS(=O)(=O)c1nccc(-c2ccc(cc2)C2CCNC2)c1-c1nnn[nH]1

BDBM262345

NS(=O)(=O)c1nccc(-c2ccc(cc2)C2CCNCC2)c1-c1nnn[nH]1

BDBM262335

NS(=O)(=O)c1nccc(-c2ccc(cc2)C2CCOCC2)c1-c1nnn[nH]1

BDBM262356

NS(=O)(=O)c1nccc(-c2ccc(nc2)N2CCOCC2)c1-c1nn[nH]n1

BDBM262340

NS(=O)(=O)c1nccc(-c2ccc3C(=O)NCc3c2)c1-c1nnn[nH]1

BDBM262353

NS(=O)(=O)c1nccc(-c2ccc3NC(=O)COc3c2)c1-c1nn[nH]n1

BDBM262349

NS(=O)(=O)c1nccc(-c2ccc3NC(=O)Cc3c2)c1-c1nn[nH]n1

BDBM262357

NS(=O)(=O)c1nccc(-c2ccc3[nH]nc(c3c2)C(F)(F)F)c1-c1nn[nH]n1

BDBM262347

NS(=O)(=O)c1nccc(-c2ccc3[nH]ncc3c2)c1-c1nn[nH]n1

BDBM262361

NS(=O)(=O)c1nccc(-c2ccc3cccnc3c2)c1-c1nn[nH]n1

BDBM262351

NS(=O)(=O)c1nccc(-c2ccc3cn[nH]c3c2)c1-c1nn[nH]n1

BDBM262348

NS(=O)(=O)c1nccc(-c2ccc3ncccc3c2)c1-c1nn[nH]n1

BDBM262355

NS(=O)(=O)c1nccc(-c2ccccc2)c1-c1nn[nH]n1

BDBM262341

NS(=O)(=O)c1nccc(-c2cccnc2)c1-c1nnn[nH]1

BDBM262342

NS(=O)(=O)c1nccc(-c2ccncc2)c1-c1nnn[nH]1

BDBM262360

NS(=O)(=O)c1nccc(-c2cnc3[nH]ccc3c2)c1-c1nn[nH]n1

BDBM262370

NS(=O)(=O)c1nccc(N2CCC(CC2)N2CCCC2)c1-c1nnn[nH]1

BDBM262375

NS(=O)(=O)c1nccc(N2CCC(CC2)N2CCNCC2)c1-c1nnn[nH]1

BDBM262387

NS(=O)(=O)c1nccc(N2CCC(CC2)N2CCOCC2)c1-c1nnn[nH]1

BDBM262374

NS(=O)(=O)c1nccc(N2CCC(CC2)N2CC[C@H](O)C2)c1-c1nnn[nH]1 |r|

BDBM262379

NS(=O)(=O)c1nccc(N2CCC(CC2)Oc2ncccn2)c1-c1nnn[nH]1

BDBM262366

NS(=O)(=O)c1nccc(N2CCC(CC2)c2cccnc2)c1-c1nnn[nH]1

BDBM262365

NS(=O)(=O)c1nccc(N2CCC(CC2)c2ccncc2)c1-c1nnn[nH]1

BDBM262373

NS(=O)(=O)c1nccc(N2CCC(CC2)c2cnc3CCCCn23)c1-c1nnn[nH]1

BDBM262388

NS(=O)(=O)c1nccc(N2CCC(CC2)c2ncc[nH]2)c1-c1nnn[nH]1

BDBM262389

NS(=O)(=O)c1nccc(N2CCC(CC2)c2nnc3ccccn23)c1-c1nnc[nH]1

BDBM262376

NS(=O)(=O)c1nccc(N2CCC(CC2)n2ccnc2)c1-c1nnn[nH]1

BDBM262372

NS(=O)(=O)c1nccc(N2CCC(CN3CCOCC3)CC2)c1-c1nnn[nH]1

BDBM262386

NS(=O)(=O)c1nccc(N2CCC(Cc3ccncc3)CC2)c1-c1nnn[nH]1

BDBM262381

NS(=O)(=O)c1nccc(N2CCC(Cn3ccnc3)CC2)c1-c1nnn[nH]1

BDBM262390

NS(=O)(=O)c1nccc(N2CCC(O)CC2)c1-c1nnn[nH]1

BDBM262369

NS(=O)(=O)c1nccc(N2CCC3(CC2)NCNC3=O)c1-c1nnn[nH]1

BDBM262393

NS(=O)(=O)c1nccc(N2CCC3(CCNCC3)CC2)c1-c1nn[nH]n1

BDBM262368

NS(=O)(=O)c1nccc(N2CCCC(C2)c2ccccn2)c1-c1nnn[nH]1

BDBM262391

NS(=O)(=O)c1nccc(N2CCCC(Cc3cccnc3)C2)c1-c1nnn[nH]1

BDBM262382

NS(=O)(=O)c1nccc(NC2CCCCC2)c1-c1nnn[nH]1

BDBM262384

NS(=O)(=O)c1nccc(NCCC2CCCCC2)c1-c1nnn[nH]1

BDBM262385

NS(=O)(=O)c1nccc(NCCc2ccccc2)c1-c1nnn[nH]1

BDBM262383

NS(=O)(=O)c1nccc(NCc2ccccc2)c1-c1nnn[nH]1

BDBM262394

NS(=O)(=O)c1nccc(c1-c1nn[nH]n1)-n1cnc2ccccc12

BDBM262425

NS(=O)(=O)c1nncc(-c2ccc(Br)cc2)c1-c1nn[nH]n1

BDBM574741

NS(=O)(=O)n1ccc(OCC2CC2)c1C([O-])=O

BDBM574726

NS(=O)(=O)n1ccc(c1C(O)=O)-c1ccc(NS(=O)(=O)C2CC2)cc1

BDBM574735

NS(=O)(=O)n1ccc(c1C(O)=O)-c1ccc(cc1)C(=O)NCCC[NH3+]

BDBM574730

NS(=O)(=O)n1ccc(c1C(O)=O)-c1ccc(cc1)C1CC[NH2+]CC1

BDBM574734

NS(=O)(=O)n1ccc(c1C(O)=O)-c1ccc2nc([NH3+])nn2c1

BDBM574722

NS(=O)(=O)n1ccc(c1C(O)=O)-c1cccc(F)c1

BDBM574732

NS(=O)(=O)n1ccc(c1C(O)=O)-c1cccc(c1)C1CC[NH2+]CC1

BDBM574737

NS(=O)(=O)n1ccc(c1C(O)=O)-c1cccc2sc([NH3+])nc12

BDBM574736

NS(=O)(=O)n1ccc(c1C([O-])=O)-c1ccc(=O)[nH]c1

BDBM574721

NS(=O)(=O)n1ccc(c1C([O-])=O)-c1ccc(F)cc1

BDBM574718

NS(=O)(=O)n1ccc(c1C([O-])=O)-c1cccc2ncccc12

BDBM574716

NS(=O)(=O)n1ccc(c1C([O-])=O)-c1cccnc1

BDBM574717

NS(=O)(=O)n1ccc(c1C([O-])=O)-c1ccncc1

BDBM574742

NS(=O)(=O)n1ccc(c1C([O-])=O)-n1cccc1

BDBM361032

N[C@@H](CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O)C(N)=O |r|

BDBM361208

N[C@@H](CO)CNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361069

N[C@@H](CO)CNS(=O)(=O)c1ccc(-c2cccc(c2)C2N=CN=N2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,c:21,23|

BDBM361033

N[C@@H](CO)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361057

N[C@@H](CO)CNS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368087

N[C@@H](CO)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368170

N[C@@H](CO)CS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361182

N[C@@H]1CCCC(=C1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |c:5|

BDBM530896

N[C@@H]1CCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1 |r|

BDBM530954

N[C@@H]1CCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262874

N[C@@H]1CCCN(C1)c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r|

BDBM531023

N[C@@H]1CCCN(C1=O)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM360906

N[C@@H]1CCN(C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM531066

N[C@@H]1CCN(C[C@@H]1F)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262901

N[C@@H]1CN(CC11CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r|

BDBM361048

N[C@@H]1CN(CC[C@H]1F)S(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM361256

N[C@@H]1CNC[C@@H]1NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361170

N[C@@H]1CNC[C@@H]1NS(=O)(=O)c1ccc(-c2cccc(c2)-c2c[nH]c(N)n2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361084

N[C@@H]1CNC[C@@H]1NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361167

N[C@@H]1CNC[C@@H]1NS(=O)(=O)c1ccc(-c2cccc3ccc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361171

N[C@@H]1CNC[C@@H]1NS(=O)(=O)c1ccc(-c2cccn3ccnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361168

N[C@@H]1CNC[C@@H]1NS(=O)(=O)c1ccc(-c2cnc(N)s2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361169

N[C@@H]1CNC[C@@H]1NS(=O)(=O)c1ccc(-c2cnc3cc[nH]c3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361165

N[C@@H]1CNC[C@H]1NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM360947

N[C@@H]1CO[C@@H]2[C@H](CO[C@H]12)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM361291

N[C@@H]1C[C@H]1NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM361231

N[C@@H]1C[C@H]1NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(=O)=O |r|

BDBM427552

N[C@@H]1C[C@H]1NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM262694

N[C@@]1(CCNC1)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F |r|

BDBM361031

N[C@H](CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O)C(N)=O |r|

BDBM360997

N[C@H](CNS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O)C(O)=O |r|

BDBM361140

N[C@H](CO)CNS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361034

N[C@H](CO)CNS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361139

N[C@H](CO)CNS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368086

N[C@H](CO)CS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM368169

N[C@H](CO)CS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361166

N[C@H](CO)c1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CNC[C@H]1N |r|

BDBM360943

N[C@H](NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O)c1ccccn1 |r|

BDBM361326

N[C@H]1CC(C1)NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,wU:1.0,(7.92,1.2,;6.83,.11,;6.83,-1.43,;5.29,-1.43,;5.29,.11,;4.2,-2.52,;2.86,-1.75,;2.86,-.21,;2.86,-3.29,;1.32,-1.75,;.55,-3.08,;-.99,-3.08,;-1.76,-1.75,;-3.3,-1.75,;-4.07,-3.08,;-5.61,-3.08,;-6.38,-1.75,;-7.92,-1.75,;-5.61,-.41,;-4.07,-.41,;-.99,-.41,;-1.76,.92,;-3.3,.92,;-3.77,2.38,;-2.53,3.29,;-1.28,2.38,;.58,-.37,;1.35,.97,;2.86,.65,;2.12,2.3,;.02,1.74,)|

BDBM262603

N[C@H]1CCC(Cc2ccc(-c3ccc(cc3)C3CCNCC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |r,wD:1.0,(8.47,-5.19,;7.7,-3.85,;8.47,-2.52,;7.7,-1.18,;6.16,-1.18,;5.39,.15,;3.85,.15,;3.08,-1.18,;1.54,-1.18,;.77,.15,;-.77,.15,;-1.54,1.48,;-3.08,1.48,;-3.85,.15,;-3.08,-1.18,;-1.54,-1.18,;-5.39,.15,;-6.16,1.48,;-7.7,1.48,;-8.47,.15,;-7.7,-1.18,;-6.16,-1.18,;1.54,1.48,;.77,2.82,;-.77,2.82,;-1.25,4.28,;,5.19,;1.25,4.28,;3.08,1.48,;3.85,2.82,;5.34,2.42,;4.62,4.15,;2.52,3.59,;5.39,-2.52,;6.16,-3.85,)|

BDBM262611

N[C@H]1CCC(Cc2ccc(-c3ccc(cc3)C3CCNCC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |r,wU:1.0,(8.47,-5.19,;7.7,-3.85,;6.16,-3.85,;5.39,-2.52,;6.16,-1.18,;5.39,.15,;3.85,.15,;3.08,-1.18,;1.54,-1.18,;.77,.15,;-.77,.15,;-1.54,1.48,;-3.08,1.48,;-3.85,.15,;-3.08,-1.18,;-1.54,-1.18,;-5.39,.15,;-6.16,1.48,;-7.7,1.48,;-8.47,.15,;-7.7,-1.18,;-6.16,-1.18,;1.54,1.48,;.77,2.82,;-.77,2.82,;-1.25,4.28,;,5.19,;1.25,4.28,;3.08,1.48,;3.85,2.82,;5.18,2.05,;4.62,4.15,;2.52,3.59,;7.7,-1.18,;8.47,-2.52,)|

BDBM262599

N[C@H]1CCC(Cc2ccc(-c3ccnc4ccccc34)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |r,wD:1.0,(6.16,-5.19,;5.39,-3.85,;6.16,-2.52,;5.39,-1.18,;3.85,-1.18,;3.08,.15,;1.54,.15,;.77,-1.18,;-.77,-1.18,;-1.54,.15,;-3.08,.15,;-3.85,1.48,;-5.39,1.48,;-6.16,.15,;-5.39,-1.18,;-6.16,-2.52,;-5.39,-3.85,;-3.85,-3.85,;-3.08,-2.52,;-3.85,-1.18,;-.77,1.48,;-1.54,2.82,;-3.08,2.82,;-3.56,4.28,;-2.31,5.19,;-1.06,4.28,;.77,1.48,;1.54,2.82,;3.03,2.42,;.45,3.91,;1.94,4.3,;3.08,-2.52,;3.85,-3.85,)|

BDBM361183

N[C@H]1CCCC(=C1)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |c:5|

BDBM360910

N[C@H]1CCCN(C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM530897

N[C@H]1CCCN(C1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1 |r|

BDBM531024

N[C@H]1CCCN(C1=O)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM360905

N[C@H]1CCN(C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r|

BDBM531067

N[C@H]1CCN(C[C@H]1F)c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262788

N[C@H]1CC[C@@H](CC1)Nc1nc2c(cccc2s1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O |r,wU:4.7,wD:1.0,(-8.47,-3.17,;-6.93,-3.17,;-6.16,-4.51,;-4.62,-4.51,;-3.85,-3.17,;-4.62,-1.84,;-6.16,-1.84,;-2.31,-3.17,;-1.54,-1.84,;-.01,-1.68,;.31,-.17,;1.65,.6,;1.65,2.14,;.31,2.91,;-1.02,2.14,;-1.02,.6,;-2.17,-.43,;2.98,-.17,;2.98,-1.71,;4.31,-2.48,;5.65,-1.71,;5.65,-.17,;4.31,.6,;4.31,2.14,;3.07,3.04,;3.54,4.51,;5.08,4.51,;5.56,3.04,;6.98,.6,;8.47,1,;7.75,1.93,;7.75,-.74,)|

BDBM367991

N[C@H]1CC[C@@H](CC1)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,wU:1.0,wD:4.7,(6.16,-5.22,;5.39,-3.89,;3.85,-3.89,;3.08,-2.55,;3.85,-1.22,;5.39,-1.22,;6.16,-2.55,;3.08,.11,;4.62,.11,;4.17,1.2,;1.54,.11,;.77,-1.22,;-.77,-1.22,;-1.54,.11,;-3.08,.11,;-3.85,1.45,;-5.39,1.45,;-6.16,.11,;-5.39,-1.22,;-5.87,-2.68,;-4.62,-3.59,;-4.62,-5.13,;-3.37,-2.68,;-3.85,-1.22,;-.77,1.45,;-1.54,2.78,;-3.07,2.94,;-3.39,4.45,;-2.06,5.22,;-.91,4.19,;.8,1.5,;1.57,2.83,;2.9,2.06,;2.34,4.16,;.23,3.6,)|

BDBM262967

N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wU:1.0,wD:4.7,(-5.33,9.3,;-4,8.53,;-2.67,9.3,;-1.33,8.53,;-1.33,6.99,;-2.67,6.22,;-4,6.99,;,6.22,;1.33,6.99,;2.67,6.22,;2.72,4.65,;1.33,3.91,;,4.68,;-1.33,3.91,;-1.33,2.37,;-2.8,1.89,;-3.7,3.14,;-2.8,4.39,;1.33,2.37,;2.67,1.6,;,1.6,;2.67,3.14,;4.05,3.88,;5.38,3.11,;3.28,2.55,;4.82,5.22,)|

BDBM368020

N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CCNCC1 |r,wU:1.0,wD:4.7,(8.53,-2.69,;7.19,-1.92,;5.86,-2.69,;4.53,-1.92,;4.53,-.38,;5.86,.39,;7.19,-.38,;3.19,.39,;3.19,1.93,;1.86,2.7,;.53,1.93,;.53,.39,;1.86,-.38,;1.86,-1.92,;3.11,-2.82,;2.63,-4.29,;1.09,-4.29,;.61,-2.82,;-.81,-.38,;-.04,-1.71,;-2.14,-1.15,;-1.58,.96,;-.81,2.7,;-.04,4.04,;-1.95,1.67,;-2.14,3.47,;-2.14,5.01,;-3.48,5.78,;-4.81,5.01,;-4.81,3.47,;-3.48,2.7,)|

BDBM368025

N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1 |r,wU:4.7,wD:1.0,(.1,7.8,;.1,6.26,;-1.24,5.49,;-1.24,3.95,;.1,3.18,;1.43,3.95,;1.43,5.49,;.1,1.64,;-1.24,.87,;-1.24,-.67,;.1,-1.44,;1.43,-.67,;1.43,.87,;2.76,1.64,;2.93,3.17,;4.43,3.49,;5.2,2.16,;4.17,1.01,;2.76,-1.44,;3.53,-.11,;4.1,-2.21,;1.99,-2.78,;.1,-2.98,;-1.44,-2.98,;1.56,-3.46,;.1,-4.52,;1.19,-5.61,;.1,-6.7,;-.99,-5.61,)|

BDBM368017

N[C@H]1CC[C@@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CC1CNC1 |r,wU:4.7,wD:1.0,(8.24,3.53,;7.47,2.19,;5.93,2.19,;5.16,.86,;5.93,-.47,;7.47,-.47,;8.24,.86,;5.16,-1.81,;3.62,-1.81,;2.85,-3.14,;3.62,-4.47,;5.16,-4.47,;5.93,-3.14,;7.47,-3.14,;8.38,-4.39,;9.84,-3.91,;9.84,-2.37,;8.38,-1.89,;5.93,-5.81,;6.7,-7.14,;4.9,-6.95,;7.27,-5.04,;2.85,-5.81,;2.08,-7.14,;1.52,-5.04,;4.19,-6.58,;4.19,-8.12,;5.28,-9.21,;4.19,-10.3,;3.1,-9.21,)|

BDBM262725

N[C@H]1CC[C@@H](CCc2ccc(-c3ccc(N)nc3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,1.0,(8.85,-2.52,;7.31,-2.52,;6.54,-3.85,;5,-3.85,;4.23,-2.52,;2.69,-2.52,;1.93,-1.18,;.38,-1.18,;-.38,-2.52,;-1.93,-2.52,;-2.69,-1.18,;-4.23,-1.18,;-5,-2.52,;-6.54,-2.52,;-7.31,-1.18,;-8.85,-1.18,;-6.54,.15,;-5,.15,;-1.93,.15,;-2.69,1.48,;-4.23,1.48,;-4.71,2.95,;-3.47,3.85,;-2.22,2.95,;-.36,.2,;.41,1.53,;1.75,.76,;1.18,2.86,;-.92,2.3,;5,-1.18,;6.54,-1.18,)|

BDBM262732

N[C@H]1CC[C@@H](CCc2ccc(-c3ccc(cc3)C3CCNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,1.0,(9.52,-5.11,;8.19,-4.34,;6.86,-5.11,;5.52,-4.34,;5.52,-2.8,;4.19,-2.03,;3.42,-.7,;2.09,.07,;1.32,-1.26,;-.22,-1.26,;-.99,.07,;-2.53,.07,;-3.3,-1.26,;-4.84,-1.26,;-5.61,.07,;-4.84,1.41,;-3.3,1.41,;-7.15,.07,;-8.06,1.32,;-9.52,.84,;-9.52,-.7,;-8.06,-1.17,;-.22,1.41,;-.99,2.74,;-2.53,2.74,;-3.01,4.21,;-1.76,5.11,;-.52,4.21,;1.32,1.41,;2.09,2.74,;3.42,1.97,;3.42,3.51,;2.09,4.28,;6.86,-2.03,;8.19,-2.8,)|

BDBM262610

N[C@H]1CC[C@@H](CCc2ccc(-c3ccc(cc3)C3CCNCC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |r,wU:4.4,1.0,(10.39,-2.52,;8.85,-2.52,;8.08,-3.85,;6.54,-3.85,;5.78,-2.52,;4.23,-2.52,;3.47,-1.18,;1.93,-1.18,;1.15,-2.52,;-.38,-2.52,;-1.15,-1.18,;-2.69,-1.18,;-3.47,.15,;-5,.15,;-5.78,-1.18,;-5,-2.52,;-3.47,-2.52,;-7.31,-1.18,;-8.08,.15,;-9.63,.15,;-10.39,-1.18,;-9.63,-2.52,;-8.08,-2.52,;-.38,.15,;-1.15,1.48,;-2.69,1.48,;-3.17,2.95,;-1.93,3.85,;-.68,2.95,;1.15,.15,;1.93,1.48,;3.26,.71,;2.69,2.82,;.59,2.25,;6.54,-1.18,;8.08,-1.18,)|

BDBM262747

N[C@H]1CC[C@@H](CCc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,1.0,(8.28,-5.8,;6.94,-5.03,;5.61,-5.8,;4.28,-5.03,;4.28,-3.49,;2.94,-2.72,;2.94,-1.18,;1.61,-.41,;.28,-1.18,;-1.06,-.41,;-1.06,1.13,;-2.39,1.9,;-2.39,3.44,;-3.72,4.21,;-5.06,3.44,;-5.06,1.9,;-3.72,1.13,;-6.39,4.21,;-6.79,5.69,;-8.28,5.29,;-7.88,3.81,;.28,1.9,;.28,3.44,;-.97,4.34,;-.49,5.8,;1.05,5.8,;1.52,4.34,;1.66,1.15,;2.99,1.92,;3.76,.59,;4.33,2.69,;2.22,3.26,;5.61,-2.72,;6.94,-3.49,)|

BDBM262580

N[C@H]1CC[C@@H](CCc2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)C(F)(F)F)CC1 |r,wU:4.4,1.0,(-7.31,-8.49,;-5.78,-8.49,;-5,-7.16,;-3.47,-7.16,;-2.69,-8.49,;-1.15,-8.49,;-.38,-7.16,;1.15,-7.16,;1.93,-8.49,;3.47,-8.49,;4.33,-7.19,;3.47,-5.82,;1.93,-5.82,;1.15,-4.49,;-.38,-4.49,;-.86,-3.03,;.38,-2.12,;1.63,-3.03,;4.23,-4.49,;5.72,-4.89,;3.15,-3.4,;4.63,-3,;5.87,-7.21,;7.41,-7.22,;5.85,-8.75,;5.88,-5.67,;-3.47,-9.83,;-5,-9.83,)|

BDBM262721

N[C@H]1CC[C@@H](Cc2ccc(-c3ccc(N)nc3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,1.0,(6.93,-5.19,;6.16,-3.85,;4.62,-3.85,;3.85,-2.52,;4.62,-1.18,;3.85,.15,;2.31,.15,;1.54,-1.18,;,-1.18,;-.77,.15,;-2.31,.15,;-3.08,-1.18,;-4.62,-1.18,;-5.39,.15,;-6.93,.15,;-4.62,1.48,;-3.08,1.48,;,1.48,;-.77,2.82,;-2.31,2.82,;-2.79,4.28,;-1.54,5.19,;-.29,4.28,;1.57,1.53,;2.34,2.86,;3.67,2.09,;3.11,4.2,;1,3.63,;6.16,-1.18,;6.93,-2.52,)|

BDBM262730

N[C@H]1CC[C@@H](Cc2ccc(-c3ccc(cc3)C3CCNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,1.0,(8.75,-4.7,;7.66,-3.61,;6.18,-4.01,;5.09,-2.92,;5.49,-1.43,;4.4,-.34,;2.86,-.34,;2.09,-1.67,;.55,-1.67,;-.22,-.34,;-1.76,-.34,;-2.53,-1.67,;-4.07,-1.67,;-4.84,-.34,;-4.07,.99,;-2.53,.99,;-6.38,-.34,;-7.29,.91,;-8.75,.43,;-8.75,-1.11,;-7.29,-1.59,;.55,.99,;-.22,2.33,;-1.76,2.33,;-2.24,3.79,;-.99,4.7,;.25,3.79,;2.09,.99,;2.86,2.33,;4.19,1.56,;3.63,3.66,;1.52,3.1,;6.97,-1.03,;8.06,-2.12,)|

BDBM262743

N[C@H]1CC[C@@H](Cc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,1.0,(4.94,-6.57,;4.94,-5.03,;3.61,-4.26,;3.61,-2.72,;4.94,-1.95,;4.94,-.41,;3.61,.36,;2.28,-.41,;.94,.36,;.94,1.9,;-.39,2.67,;-.39,4.21,;-1.72,4.98,;-3.06,4.21,;-3.06,2.67,;-1.72,1.9,;-4.39,4.98,;-4.79,6.46,;-6.28,6.06,;-5.88,4.58,;2.28,2.67,;2.28,4.21,;1.03,5.11,;1.51,6.57,;3.05,6.57,;3.52,5.11,;3.66,1.92,;4.99,2.69,;5.76,1.36,;6.33,3.46,;4.22,4.03,;6.28,-2.72,;6.28,-4.26,)|

BDBM367990

N[C@H]1CC[C@H](CC1)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,wU:4.7,1.0,(6.16,-5.22,;5.39,-3.89,;3.85,-3.89,;3.08,-2.55,;3.85,-1.22,;5.39,-1.22,;6.16,-2.55,;3.08,.11,;4.62,.11,;4.17,1.2,;1.54,.11,;.77,-1.22,;-.77,-1.22,;-1.54,.11,;-3.08,.11,;-3.85,1.45,;-5.39,1.45,;-6.16,.11,;-5.39,-1.22,;-5.87,-2.68,;-4.62,-3.59,;-4.62,-5.13,;-3.37,-2.68,;-3.85,-1.22,;-.77,1.45,;-1.54,2.78,;-3.07,2.94,;-3.39,4.45,;-2.06,5.22,;-.91,4.19,;.8,1.5,;1.57,2.83,;2.9,2.06,;2.34,4.16,;.23,3.6,)|

BDBM262966

N[C@H]1CC[C@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F |r,wD:1.0,4.7,(-5.33,9.3,;-4,8.53,;-4,6.99,;-2.67,6.22,;-1.33,6.99,;-1.33,8.53,;-2.67,9.3,;,6.22,;1.33,6.99,;2.67,6.22,;2.72,4.65,;1.33,3.91,;,4.68,;-1.33,3.91,;-1.33,2.37,;-2.8,1.89,;-3.7,3.14,;-2.8,4.39,;1.33,2.37,;2.67,1.6,;,1.6,;2.67,3.14,;4.05,3.88,;5.38,3.11,;3.28,2.55,;4.82,5.22,)|

BDBM368021

N[C@H]1CC[C@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CCNCC1 |r,wU:1.0,4.7,(8.53,-2.69,;7.19,-1.92,;5.86,-2.69,;4.53,-1.92,;4.53,-.38,;5.86,.39,;7.19,-.38,;3.19,.39,;3.19,1.93,;1.86,2.7,;.53,1.93,;.53,.39,;1.86,-.38,;1.86,-1.92,;3.11,-2.82,;2.63,-4.29,;1.09,-4.29,;.61,-2.82,;-.81,-.38,;-.04,-1.71,;-2.14,-1.15,;-1.58,.96,;-.81,2.7,;-.04,4.04,;-1.95,1.67,;-2.14,3.47,;-2.14,5.01,;-3.48,5.78,;-4.81,5.01,;-4.81,3.47,;-3.48,2.7,)|

BDBM368026

N[C@H]1CC[C@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1 |r,wU:1.0,4.7,(.1,7.8,;.1,6.26,;1.43,5.49,;1.43,3.95,;.1,3.18,;-1.24,3.95,;-1.24,5.49,;.1,1.64,;-1.24,.87,;-1.24,-.67,;.1,-1.44,;1.43,-.67,;1.43,.87,;2.76,1.64,;2.93,3.17,;4.43,3.49,;5.2,2.16,;4.17,1.01,;2.76,-1.44,;3.53,-.11,;4.1,-2.21,;1.99,-2.78,;.1,-2.98,;-1.44,-2.98,;1.56,-3.46,;.1,-4.52,;1.19,-5.61,;.1,-6.7,;-.99,-5.61,)|

BDBM368018

N[C@H]1CC[C@H](CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)CC1CNC1 |r,wU:4.7,1.0,(8.24,3.53,;7.47,2.19,;8.24,.86,;7.47,-.47,;5.93,-.47,;5.16,.86,;5.93,2.19,;5.16,-1.81,;3.62,-1.81,;2.85,-3.14,;3.62,-4.47,;5.16,-4.47,;5.93,-3.14,;7.47,-3.14,;8.38,-4.39,;9.84,-3.91,;9.84,-2.37,;8.38,-1.89,;5.93,-5.81,;6.7,-7.14,;4.9,-6.95,;7.27,-5.04,;2.85,-5.81,;2.08,-7.14,;1.52,-5.04,;4.19,-6.58,;4.19,-8.12,;5.28,-9.21,;4.19,-10.3,;3.1,-9.21,)|

BDBM262724

N[C@H]1CC[C@H](CCc2ccc(-c3ccc(N)nc3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,wD:1.0,(8.85,-2.52,;7.31,-2.52,;6.54,-1.18,;5,-1.18,;4.23,-2.52,;2.69,-2.52,;1.93,-1.18,;.38,-1.18,;-.38,-2.52,;-1.93,-2.52,;-2.69,-1.18,;-4.23,-1.18,;-5,-2.52,;-6.54,-2.52,;-7.31,-1.18,;-8.85,-1.18,;-6.54,.15,;-5,.15,;-1.93,.15,;-2.69,1.48,;-4.23,1.48,;-4.71,2.95,;-3.47,3.85,;-2.22,2.95,;-.36,.2,;.41,1.53,;1.75,.76,;1.18,2.86,;-.92,2.3,;5,-3.85,;6.54,-3.85,)|

BDBM262731

N[C@H]1CC[C@H](CCc2ccc(-c3ccc(cc3)C3CCNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,wD:1.0,(9.52,-5.11,;8.19,-4.34,;8.19,-2.8,;6.86,-2.03,;5.52,-2.8,;4.19,-2.03,;3.42,-.7,;2.09,.07,;1.32,-1.26,;-.22,-1.26,;-.99,.07,;-2.53,.07,;-3.3,-1.26,;-4.84,-1.26,;-5.61,.07,;-4.84,1.41,;-3.3,1.41,;-7.15,.07,;-8.06,1.32,;-9.52,.84,;-9.52,-.7,;-8.06,-1.17,;-.22,1.41,;-.99,2.74,;-2.53,2.74,;-3.01,4.21,;-1.76,5.11,;-.52,4.21,;1.32,1.41,;2.09,2.74,;3.42,1.97,;3.42,3.51,;1.32,4.07,;5.52,-4.34,;6.86,-5.11,)|

BDBM262609

N[C@H]1CC[C@H](CCc2ccc(-c3ccc(cc3)C3CCNCC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |r,wU:4.4,wD:1.0,(10.39,-2.52,;8.85,-2.52,;8.08,-1.18,;6.54,-1.18,;5.78,-2.52,;4.23,-2.52,;3.47,-1.18,;1.93,-1.18,;1.15,-2.52,;-.38,-2.52,;-1.15,-1.18,;-2.69,-1.18,;-3.47,.15,;-5,.15,;-5.78,-1.18,;-5,-2.52,;-3.47,-2.52,;-7.31,-1.18,;-8.08,.15,;-9.63,.15,;-10.39,-1.18,;-9.63,-2.52,;-8.08,-2.52,;-.38,.15,;-1.15,1.48,;-2.69,1.48,;-3.17,2.95,;-1.93,3.85,;-.68,2.95,;1.15,.15,;1.93,1.48,;3.26,.71,;2.69,2.82,;.59,2.25,;6.54,-3.85,;8.08,-3.85,)|

BDBM262746

N[C@H]1CC[C@H](CCc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,wD:1.0,(8.28,-5.8,;6.94,-5.03,;6.94,-3.49,;5.61,-2.72,;4.28,-3.49,;2.94,-2.72,;2.94,-1.18,;1.61,-.41,;.28,-1.18,;-1.06,-.41,;-1.06,1.13,;-2.39,1.9,;-2.39,3.44,;-3.72,4.21,;-5.06,3.44,;-5.06,1.9,;-3.72,1.13,;-6.39,4.21,;-6.79,5.69,;-8.28,5.29,;-7.88,3.81,;.28,1.9,;.28,3.44,;-.97,4.34,;-.49,5.8,;1.05,5.8,;1.52,4.34,;1.66,1.15,;2.99,1.92,;3.76,.59,;4.33,2.69,;2.22,3.26,;4.28,-5.03,;5.61,-5.8,)|

BDBM262579

N[C@H]1CC[C@H](CCc2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)C(F)(F)F)CC1 |r,wU:4.4,wD:1.0,(-7.31,-8.49,;-5.78,-8.49,;-5,-9.83,;-3.47,-9.83,;-2.69,-8.49,;-1.15,-8.49,;-.38,-7.16,;1.15,-7.16,;1.93,-8.49,;3.47,-8.49,;4.33,-7.19,;3.47,-5.82,;1.93,-5.82,;1.15,-4.49,;-.38,-4.49,;-.86,-3.03,;.38,-2.12,;1.63,-3.03,;4.23,-4.49,;5.72,-4.89,;3.15,-3.4,;4.63,-3,;5.87,-7.21,;7.41,-7.22,;5.85,-8.75,;5.88,-5.67,;-3.47,-7.16,;-5,-7.16,)|

BDBM262722

N[C@H]1CC[C@H](Cc2ccc(-c3ccc(N)nc3)c(-c3nnn[nH]3)c2S(N)(=O)=O)CC1 |r,wU:4.4,wD:1.0,(6.93,-5.19,;6.16,-3.85,;6.93,-2.52,;6.16,-1.18,;4.62,-1.18,;3.85,.15,;2.31,.15,;1.54,-1.18,;,-1.18,;-.77,.15,;-2.31,.15,;-3.08,-1.18,;-4.62,-1.18,;-5.39,.15,;-6.93,.15,;-4.62,1.48,;-3.08,1.48,;,1.48,;-.77,2.82,;-2.31,2.82,;-2.79,4.28,;-1.54,5.19,;-.29,4.28,;1.57,1.53,;2.34,2.86,;3.67,2.09,;3.11,4.2,;1,3.63,;3.85,-2.52,;4.62,-3.85,)|

BDBM262729

N[C@H]1CC[C@H](Cc2ccc(-c3ccc(cc3)C3CCNC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |r,wU:1.0,wD:4.4,(9.24,-4.06,;7.91,-3.29,;6.57,-4.06,;5.24,-3.29,;5.24,-1.75,;3.91,-.98,;2.37,-.98,;1.6,-2.31,;.06,-2.31,;-.71,-.98,;-2.25,-.98,;-3.02,.36,;-4.56,.36,;-5.33,-.98,;-4.56,-2.31,;-3.02,-2.31,;-6.87,-.98,;-7.78,.27,;-9.24,-.21,;-9.24,-1.75,;-7.78,-2.22,;.06,.36,;-.71,1.69,;-2.25,1.69,;-2.73,3.15,;-1.48,4.06,;-.24,3.15,;1.63,.4,;2.39,1.74,;3.73,.97,;3.16,3.07,;1.06,2.51,;6.57,-.98,;7.91,-1.75,)|

BDBM262742

N[C@H]1CC[C@H](Cc2ccc(-c3ccc(cc3)C3CNC3)c(-c3nn[nH]n3)c2S(N)(=O)=O)CC1 |r,wU:4.4,wD:1.0,(5.81,-5.6,;5.81,-4.06,;7.15,-3.29,;7.15,-1.75,;5.81,-.98,;5.81,.56,;4.27,.56,;3.5,-.77,;1.96,-.77,;1.19,.56,;-.35,.56,;-1.12,1.9,;-2.66,1.9,;-3.43,.56,;-2.66,-.77,;-1.12,-.77,;-4.97,.56,;-6.06,1.65,;-7.15,.56,;-6.06,-.53,;1.96,1.9,;1.19,3.23,;-.35,3.23,;-.82,4.69,;.42,5.6,;1.67,4.69,;3.53,1.94,;4.3,3.28,;2.97,4.05,;5.07,4.61,;5.63,2.51,;4.48,-1.75,;4.48,-3.29,)|

BDBM361257

N[C@H]1CNCC1NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM427578

N[C@H]1CNC[C@H]1NS(=O)(=O)c1ccc(-c2ccc(N)nc2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361083

N[C@H]1CNC[C@H]1NS(=O)(=O)c1ccc(-c2cccc3[nH]c(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361162

N[C@H]1CNC[C@H]1NS(=O)(=O)c1ccc(-c2cccc3ccc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361164

N[C@H]1CNC[C@H]1NS(=O)(=O)c1ccc(-c2cnc(N)s2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361163

N[C@H]1CNC[C@H]1NS(=O)(=O)c1ccc(-c2cnc3cc[nH]c3c2)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM361043

N[C@H]1C[C@@H](C1)NS(=O)(=O)c1ccc(-c2cccc3[nH]cnc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,wU:3.5,wD:1.0,(6.7,-4.83,;5.93,-3.5,;6.33,-2.01,;4.85,-1.61,;4.45,-3.1,;4.08,-.28,;2.54,-.28,;2.54,-1.82,;3.31,1.06,;1,-.28,;.23,-1.61,;-1.31,-1.61,;-2.08,-.28,;-3.62,-.28,;-4.39,1.06,;-5.93,1.06,;-6.7,-.28,;-5.93,-1.61,;-6.41,-3.07,;-5.16,-3.98,;-3.92,-3.07,;-4.39,-1.61,;-1.31,1.06,;-2.08,2.39,;-3.62,2.55,;-3.94,4.06,;-2.6,4.83,;-1.46,3.8,;.25,1.11,;1.02,2.44,;2.36,1.67,;1.79,3.77,;-.31,3.21,)|

BDBM360915

N[C@H]1C[C@@H](C1)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r,wU:3.5,wD:1.0,(6.24,-6.26,;5.47,-4.93,;5.87,-3.44,;4.38,-3.04,;3.98,-4.53,;3.05,-2.27,;3.05,-.73,;4.38,.04,;4.38,-1.5,;1.72,.04,;.38,-.73,;-.95,.04,;-.95,1.58,;-2.29,2.35,;-2.29,3.89,;-3.62,4.66,;-4.95,3.89,;-4.95,2.35,;-6.1,1.32,;-5.47,-.09,;-6.24,-1.42,;-3.94,.07,;-3.62,1.58,;.38,2.35,;.38,3.89,;1.63,4.8,;1.15,6.26,;-.39,6.26,;-.86,4.8,;1.72,1.58,;3.05,2.35,;4.38,3.12,;4.38,1.58,;3.45,3.84,)|

BDBM360942

N[C@H]1C[C@@H](C1)NS(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nnn[nH]2)c1S(N)(=O)=O |r,wU:3.5,wD:1.0,(6.92,-4.81,;5.59,-4.04,;5.19,-2.55,;3.7,-2.95,;4.1,-4.44,;2.37,-2.18,;2.37,-.64,;3.7,-1.41,;3.7,.13,;1.03,.13,;-.3,-.64,;-1.63,.13,;-1.63,1.67,;-2.97,2.44,;-2.97,3.98,;-4.3,4.75,;-5.63,3.98,;-5.63,2.44,;-6.78,1.41,;-6.15,-0,;-6.92,-1.33,;-4.62,.16,;-4.3,1.67,;-.3,2.44,;-.3,3.98,;.95,4.88,;.47,6.35,;-1.07,6.35,;-1.54,4.88,;1.03,1.67,;2.37,2.44,;3.7,3.21,;3.7,1.67,;2.77,3.92,)|

BDBM367988

N[C@H]1C[C@@H](C1)S(=O)(=O)c1ccc(-c2cccc3nc(N)[nH]c23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,wU:3.5,wD:1.0,(5.93,3.71,;5.16,5.04,;5.56,6.53,;4.08,6.93,;3.68,5.44,;3.31,8.26,;4.08,9.59,;4.85,8.26,;1.77,8.26,;1,6.93,;-.54,6.93,;-1.31,8.26,;-2.85,8.26,;-3.62,9.59,;-5.16,9.59,;-5.93,8.26,;-5.16,6.93,;-5.64,5.46,;-4.39,4.56,;-4.39,3.02,;-3.15,5.46,;-3.62,6.93,;-.54,9.59,;-1.31,10.93,;-2.85,10.93,;-3.33,12.39,;-2.08,13.3,;-.84,12.39,;1.02,9.64,;1.79,10.98,;3.13,10.21,;2.56,12.31,;.46,11.75,)|

BDBM367992

N[C@H]1C[C@@H](C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,wU:3.5,wD:1.0,(5.93,-4.48,;5.16,-3.15,;5.56,-1.66,;4.08,-1.26,;3.68,-2.75,;3.31,.07,;4.85,.07,;4.39,1.16,;1.77,.07,;1,-1.26,;-.54,-1.26,;-1.31,.07,;-2.85,.07,;-3.62,1.4,;-5.16,1.4,;-5.93,.07,;-5.16,-1.26,;-5.64,-2.73,;-4.39,-3.63,;-4.39,-5.17,;-3.15,-2.73,;-3.62,-1.26,;-.54,1.4,;-1.31,2.74,;-2.85,2.9,;-3.17,4.4,;-1.83,5.17,;-.69,4.14,;1.02,1.45,;1.79,2.78,;3.13,2.01,;2.56,4.12,;.46,3.55,)|

BDBM427274

N[C@H]1C[C@@H]1NS(=O)(=O)c1ccc(-c2cccnc2N)c(-c2nn[nH]n2)c1S(N)(=O)=O |r|

BDBM367993

N[C@H]1C[C@H](C1)S(=O)(=O)c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O |r,wU:3.5,1.0,(5.93,-4.48,;5.16,-3.15,;3.68,-2.75,;4.08,-1.26,;5.56,-1.66,;3.31,.07,;4.85,.07,;4.39,1.16,;1.77,.07,;1,-1.26,;-.54,-1.26,;-1.31,.07,;-2.85,.07,;-3.62,1.4,;-5.16,1.4,;-5.93,.07,;-5.16,-1.26,;-5.64,-2.73,;-4.39,-3.63,;-4.39,-5.17,;-3.15,-2.73,;-3.62,-1.26,;-.54,1.4,;-1.31,2.74,;-2.85,2.9,;-3.17,4.4,;-1.83,5.17,;-.69,4.14,;1.02,1.45,;1.79,2.78,;3.13,2.01,;2.56,4.12,;.46,3.55,)|

BDBM262695

N[C@]1(CCNC1)c1ccc(cc1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F |r|

BDBM262279

Nc1[nH]nc2cc(ccc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262280

Nc1[nH]nc2ccc(cc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM50270747

Nc1c(C#N)c(c(-c2ccccc2)n1Cc1ccccc1)-c1ccccc1

BDBM368187

Nc1c(NCCO)cccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368100

Nc1c(NS(=O)=O)cccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368009

Nc1c(cccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1)C#N

BDBM360976

Nc1c(cccc1-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1)C#N |r|

BDBM367839

Nc1c(cccc1B(O)O)C#N

BDBM262861

Nc1cc(cc(N)n1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262281

Nc1cc(cc(N)n1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM368124

Nc1cc(ccn1)-c1cc(ccn1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361131

Nc1cc(ccn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262670

Nc1cc(cnc1N)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM368003

Nc1cc2c(cccc2o1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)[C@H]1CCNC1 |r|

BDBM367848

Nc1cc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2cn1

BDBM262563

Nc1ccc(-c2cccc(c2-c2nnn[nH]2)S(N)(=O)=O)c2ccncc12

BDBM262575

Nc1ccc(CCc2cccc(c2-c2nn[nH]n2)S(N)(=O)=O)cn1

BDBM262829

Nc1ccc(CN[C@H]2CCC(CC2)c2ccc(c(c2-c2nnn[nH]2)S(N)(=O)=O)C(F)(F)F)cn1 |r,wD:7.6,(-5.33,-4.26,;-5.33,-2.72,;-4,-1.95,;-4,-.41,;-5.33,.36,;-5.33,1.9,;-4,2.67,;-2.67,1.9,;-2.67,.36,;-1.33,-.41,;,.36,;,1.9,;-1.33,2.67,;1.33,-.41,;1.33,-1.95,;2.67,-2.72,;4,-1.95,;4,-.41,;2.67,.36,;2.67,1.9,;1.42,2.8,;1.9,4.26,;3.44,4.26,;3.91,2.8,;5.33,.36,;6.67,1.13,;6.67,-.41,;6.1,1.69,;5.33,-2.72,;6.67,-1.95,;5.33,-4.26,;6.67,-3.49,;-6.67,-.41,;-6.67,-1.95,)|

BDBM262412

Nc1ccc(cn1)-c1ccc(Br)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262723

Nc1ccc(cn1)-c1ccc(CC2CCNCC2)c(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262728

Nc1ccc(cn1)-c1ccc(CCC2CCNCC2)c(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262413

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM367837

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CCNCC1

BDBM367838

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361328

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N1CCNCC1

BDBM361336

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC1CNC1

BDBM361335

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCC1(O)CCNCC1

BDBM361338

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCC1(O)CNC1

BDBM361327

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCC1CCNC1

BDBM361060

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCc1c[nH]cn1

BDBM361061

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCc1ncc[nH]1

BDBM361331

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CCCN1 |r|

BDBM361334

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CCNC1 |r|

BDBM361155

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CNCCN1 |r|

BDBM361212

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@]1(N)CCNC1 |r|

BDBM361332

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H]1CCCN1 |r|

BDBM361158

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H]1CNCCN1 |r|

BDBM361211

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@]1(N)CCNC1 |r|

BDBM361333

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCCNC1 |r|

BDBM361037

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361337

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCCNC1 |r|

BDBM361038

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM361253

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CNC[C@H]1O |r|

BDBM361254

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CN[C@H](CO)C1 |r|

BDBM367823

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)C1CCNCC1

BDBM360998

Nc1ccc(cn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(N)(=O)=O

BDBM262446

Nc1ccc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM574744

Nc1ccc(cn1)-c1ccn(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM574712

Nc1ccc(cn1)-c1ccn(c1C(O)=O)S(N)(=O)=O

BDBM262363

Nc1ccc(cn1)-c1ccnc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262709

Nc1ccc(nc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262892

Nc1ccc2cc(ccc2n1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262551

Nc1ccc2cc(ccc2n1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262701

Nc1ccc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)C(F)(F)F)c2n1

BDBM367849

Nc1ccc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2n1

BDBM361129

Nc1ccc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)N[C@@H]3CCNC3)c2n1 |r|

BDBM360345

Nc1ccc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(N)(=O)=O)c2n1

BDBM367830

Nc1ccc2ncc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)C3CNC3)n2n1

BDBM50240870

Nc1cccc(c1)-c1cc(nc(c1)C(O)=O)C(O)=O

BDBM368036

Nc1cccc(n1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361120

Nc1cccc(n1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262673

Nc1cccc2c(cc(nc12)C(O)=O)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM50174312

Nc1ccccc1-c1nnc(SCC(=O)Nc2cccc(Cl)c2)[nH]1

BDBM50174311

Nc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2)[nH]1

BDBM50174314

Nc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2Cl)[nH]1

BDBM262566

Nc1cccn2c(cnc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262626

Nc1ccnc2cc(ccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262560

Nc1ccnc2cc(ccc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262627

Nc1ccnc2ccc(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262549

Nc1ccnc2ccc(cc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM367878

Nc1cn2cccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2n1

BDBM262550

Nc1cnc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262564

Nc1cnc2cc(ccc2c1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM361062

Nc1cncc(c1)-c1ccc(SN[C@@H]2CCNC2)c(c1-c1nn[nH]n1)S(N)(=O)=O |r|

BDBM427277

Nc1cncc(c1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM367925

Nc1cncc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM574724

Nc1cncc(c1)-c1ccn(c1C(O)=O)S(N)(=O)=O

BDBM262285

Nc1cncc(n1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM367918

Nc1cnccc1-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM367834

Nc1n[nH]c2c(cccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM367833

Nc1n[nH]c2cc(ccc12)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262625

Nc1n[nH]c2cc(ccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262628

Nc1n[nH]c2ccc(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM368077

Nc1n[nH]c2ccc(cc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368076

Nc1n[nH]c2cccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c12

BDBM262897

Nc1nc(N)c2ccc(cc2n1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM427458

Nc1nc(c[nH]1)-c1cc(ccn1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM361271

Nc1nc(c[nH]1)-c1cccc(c1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361137

Nc1nc(c[nH]1)-c1cccc(c1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM262879

Nc1nc(cs1)-c1ccc(cc1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM361074

Nc1nc(n[nH]1)-c1cccc(c1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1

BDBM262890

Nc1nc2c(F)cc(cc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM361242

Nc1nc2c(cc(F)cc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM361024

Nc1nc2c(cc(F)cc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361077

Nc1nc2c(cc(I)cc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM367851

Nc1nc2c(ccc(C(O)=O)c2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368064

Nc1nc2c(ccc(F)c2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM367847

Nc1nc2c(ccc(c2s1)C(F)(F)F)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM367687

Nc1nc2c(cccc2[nH]1)-c1ccc(SC2CNC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367866

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CN(CCO)C1

BDBM367856

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361004

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC1CCNC1

BDBM361103

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC1CCNCC1

BDBM361095

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC1CNC1

BDBM361050

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCC1CCN1

BDBM361049

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCC1COCCN1

BDBM361105

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CCCN1 |r|

BDBM361106

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CCNC1 |r|

BDBM361153

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CNCCN1 |r|

BDBM361094

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@]1(N)CCNC1 |r|

BDBM361104

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H]1CCCN1 |r|

BDBM361102

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H]1CCNC1 |r|

BDBM361157

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H]1CNCCN1 |r|

BDBM361093

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@]1(N)CCNC1 |r|

BDBM361005

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM368163

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)[C@@H]1CN[C@H](CO)C1 |r|

BDBM368104

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)[C@H]1CN[C@H](CO)C1 |r|

BDBM367826

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)C1CNC1

BDBM361021

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCCNC1 |r|

BDBM361013

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CNC[C@@H]1O |r|

BDBM361014

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CNC[C@H]1O |r|

BDBM361017

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CN[C@@H](CO)C1 |r|

BDBM361018

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CN[C@H](CO)C1 |r|

BDBM361019

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@]1(CO)CCNC1 |r|

BDBM361022

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCCNC1 |r|

BDBM361012

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CNC[C@@H]1O |r|

BDBM361011

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CNC[C@H]1O |r|

BDBM361016

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CN[C@@H](CO)C1 |r|

BDBM361015

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CN[C@H](CO)C1 |r|

BDBM361020

Nc1nc2c(cccc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@]1(CO)CCNC1 |r|

BDBM367850

Nc1nc2c(cccc2c(=O)[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368132

Nc1nc2c(cccc2c[n+]1[O-])-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCO

BDBM368186

Nc1nc2c(cccc2n1CCO)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM367843

Nc1nc2c(cccc2o1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361002

Nc1nc2c(cccc2o1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N1CCNCC1

BDBM368002

Nc1nc2c(cccc2o1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)[C@@H]1CCNC1 |r|

BDBM360848

Nc1nc2c(cccc2o1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(N)(=O)=O

BDBM262679

Nc1nc2c(cccc2s1)-c1ccc(C(F)CO)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262682

Nc1nc2c(cccc2s1)-c1ccc(CC2CCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262692

Nc1nc2c(cccc2s1)-c1ccc(CC2CNC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262685

Nc1nc2c(cccc2s1)-c1ccc(CCC(O)=O)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262687

Nc1nc2c(cccc2s1)-c1ccc(CCC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262681

Nc1nc2c(cccc2s1)-c1ccc(CCCCCO)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262680

Nc1nc2c(cccc2s1)-c1ccc(CCCO)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM262678

Nc1nc2c(cccc2s1)-c1ccc(CCO)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM361230

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(=O)=O)S(=O)(=O)NCC1(O)CNC1

BDBM368130

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM367908

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CC1(N)CC1

BDBM368071

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCN1CCOCC1=O

BDBM368127

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)CCO

BDBM360986

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N1CCNCC1

BDBM360990

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC1CNC1

BDBM360996

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCC(O)=O

BDBM360993

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCC1(N)CC1

BDBM427551

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCC1(O)CNC1

BDBM360988

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NCCO

BDBM361210

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@]1(N)CCNC1 |r|

BDBM361209

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@]1(N)CCNC1 |r|

BDBM367996

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)[C@@H]1CCNC1 |r|

BDBM368162

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)[C@@H]1CN[C@H](CO)C1 |r|

BDBM367997

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)[C@H]1CCNC1 |r|

BDBM368105

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)[C@H]1CN[C@H](CO)C1 |r|

BDBM368063

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)c1cccc(c1)C(F)(F)F

BDBM360987

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(N)(=O)=O

BDBM262571

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM360886

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CC(F)(F)C1

BDBM360892

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CC2(C1)CCNC2

BDBM360884

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CC2CC1CS2(=O)=O |TLB:25:28:33.34:31|

BDBM360869

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CCC(CO)CC1

BDBM360887

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CCC(F)(F)C1

BDBM360899

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CCC(N)(CO)C1

BDBM360936

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CCN(CCO)CC1

BDBM360872

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CCNC(=O)C1

BDBM360873

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CCOCC1

BDBM360888

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N1CCS(=O)CC1

BDBM360955

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC1C2CNCC12

BDBM360932

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC1CC2CNC1C2

BDBM360876

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC1CCNCC1

BDBM360858

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC1CCS(=O)(=O)CC1

BDBM360879

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC1CCc2nccn2C1

BDBM360941

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC1CN2CCC1CC2 |(-6.65,-1.33,;-5.88,-0,;-4.34,.16,;-4.02,1.67,;-2.69,2.44,;-2.69,3.98,;-4.02,4.75,;-5.36,3.98,;-5.36,2.44,;-6.5,1.41,;-1.36,1.67,;-1.36,.13,;-.02,-.64,;1.31,.13,;1.31,1.67,;-.02,2.44,;-.02,3.98,;1.22,4.88,;.75,6.35,;-.79,6.35,;-1.27,4.88,;2.64,2.44,;3.98,3.21,;3.98,1.67,;3.04,3.92,;2.64,-.64,;3.98,-1.41,;3.98,.13,;2.64,-2.18,;3.98,-2.95,;3.98,-4.49,;5.31,-5.26,;6.65,-4.49,;6.65,-2.95,;5.31,-2.18,;6.01,-3.4,;4.82,-4.09,)|

BDBM360963

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC1C[C@@H]2CN[C@H]1C2 |r|

BDBM360881

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1(CO)CC1

BDBM360890

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1(F)CNC1

BDBM360958

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1(N)CCOC1

BDBM360959

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1(N)CCOCC1

BDBM360930

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1(O)CCNCC1

BDBM360863

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1CCC(=O)N1

BDBM360964

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1CCNC1

BDBM360956

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1CNCCO1

BDBM360940

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCC1COCCN1

BDBM360874

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCCC1CNC1

BDBM360865

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCCN1CCC1

BDBM360877

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCCN1CCCCC1=O

BDBM360859

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCCN1CCNC(=O)C1

BDBM360969

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CCCN1 |r|

BDBM360970

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC[C@H]1CCCN1 |r|

BDBM360966

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NC[C@]1(F)CCCNC1 |r|

BDBM360950

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)NCc1ccccn1

BDBM360913

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCCNC1 |r|

BDBM360907

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM360902

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CNC[C@@H]1F |r|

BDBM360911

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCCNC1 |r|

BDBM360904

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CCNC1 |r|

BDBM360903

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CNC[C@@H]1F |r|

BDBM360894

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@H]1CO[C@@H]2[C@H](O)CO[C@@H]12 |r|

BDBM368045

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)c1ccccc1

BDBM368046

Nc1nc2c(cccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)c1ccccn1

BDBM262691

Nc1nc2c(cccc2s1)-c1ccc(cc1-c1nn[nH]n1)C(C1CCNCC1)S(N)(=O)=O

BDBM262282

Nc1nc2c(cccc2s1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM368128

Nc1nc2c(cccc2s1=O)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CCNCC1

BDBM368029

Nc1nc2c(cccn2n1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262713

Nc1nc2cc(F)cc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)C(F)(F)F)c2[nH]1

BDBM368075

Nc1nc2cc(F)cc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2[nH]1

BDBM262716

Nc1nc2cc(cc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)C(F)(F)F)c2[nH]1)C#N

BDBM262714

Nc1nc2cc(cc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)C(F)(F)F)c2[nH]1)C(F)(F)F

BDBM368074

Nc1nc2cc(cc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2[nH]1)C#N

BDBM368073

Nc1nc2cc(cc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2[nH]1)C(F)(F)F

BDBM262758

Nc1nc2cc(ccc2[nH]1)-c1ccc(CC2CNC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367686

Nc1nc2cc(ccc2[nH]1)-c1ccc(SC2CNC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367853

Nc1nc2cc(ccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM367824

Nc1nc2cc(ccc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)C1CNC1

BDBM367844

Nc1nc2cc(ccc2o1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262697

Nc1nc2cc(ccc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM368030

Nc1nc2cc(ccn2n1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262757

Nc1nc2ccc(cc2[nH]1)-c1ccc(CC2CCNCC2)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM367854

Nc1nc2ccc(cc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CCNCC1

BDBM367825

Nc1nc2ccc(cc2[nH]1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)C1CCNCC1

BDBM262699

Nc1nc2ccc(cc2[nH]1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262696

Nc1nc2ccc(cc2s1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262565

Nc1nc2ccc(cc2s1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM368028

Nc1nc2ccc(cn2n1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262759

Nc1nc2cccc(-c3ccc(CC4CCNCC4)c(c3-c3nn[nH]n3)S(N)(=O)=O)c2[nH]1

BDBM367688

Nc1nc2cccc(-c3ccc(SC4CCNCC4)c(c3-c3nn[nH]n3)S(N)(=O)=O)c2[nH]1

BDBM367860

Nc1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)C3CCN(CCO)CC3)c2[nH]1

BDBM367855

Nc1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)C3CCNCC3)c2[nH]1

BDBM368027

Nc1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)C3CNC3)n2n1

BDBM361000

Nc1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)N3CCNCC3)c2[nH]1

BDBM367994

Nc1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)[C@@H]3CCNC3)c2[nH]1 |r|

BDBM367995

Nc1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)(=O)[C@H]3CCNC3)c2[nH]1 |r|

BDBM367827

Nc1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(=O)C3CCNCC3)c2[nH]1

BDBM360338

Nc1nc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)S(N)(=O)=O)c2[nH]1

BDBM262698

Nc1nc2cccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)C(F)(F)F)c2[nH]1

BDBM262700

Nc1nc2cccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)C(F)(F)F)c2s1

BDBM262576

Nc1nc2cccc(-c3cccc(c3-c3nn[nH]n3)S(N)(=O)=O)c2[nH]1

BDBM262718

Nc1nc2cncc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)C(F)(F)F)c2[nH]1

BDBM262717

Nc1nc2nccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)C(F)(F)F)c2[nH]1

BDBM368115

Nc1nc2nccc(-c3ccc(c(c3-c3nnn[nH]3)S(N)(=O)=O)S(=O)(=O)C3CNC3)c2[nH]1

BDBM368061

Nc1ncc(-c2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)S(=O)(=O)C2CNC2)c2cccnc12

BDBM262655

Nc1ncc(CCc2ccc(c(c2-c2nn[nH]n2)S(N)(=O)=O)C(F)(F)F)cc1CO

BDBM361283

Nc1ncc([nH]1)-c1cc(ccn1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM361282

Nc1ncc([nH]1)-c1cccc(n1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262654

Nc1ncc(cc1CO)C#Cc1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262624

Nc1ncc(cc1F)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262462

Nc1ncc(cc1F)-c1cccc(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM574723

Nc1ncc(cc1F)-c1ccn(c1C(O)=O)S(N)(=O)=O

BDBM262623

Nc1ncc(cn1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262449

Nc1ncc(cn1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM574728

Nc1ncc(cn1)-c1ccn(c1C([O-])=O)S(N)(=O)=O

BDBM262683

Nc1ncc(s1)-c1ccc(-c2cccc3sc(N)nc23)c(-c2nn[nH]n2)c1S(N)(=O)=O

BDBM262572

Nc1ncc(s1)-c1ccc(Br)c(c1-c1nn[nH]n1)S(N)(=O)=O

BDBM361127

Nc1ncc(s1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1 |r|

BDBM262703

Nc1ncc2c(cccc2n1)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)C(F)(F)F

BDBM262568

Nc1ncc2ccc(cc2n1)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM262705

Nc1ncc2cccc(-c3ccc(c(c3-c3nn[nH]n3)S(N)(=O)=O)C(F)(F)F)c2n1

BDBM367840

Nc1nccc(B(O)O)c1N

BDBM368037

Nc1nccc(c1N)-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262900

Nc1nccc(n1)-c1cccc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262898

Nc1nccc2cc(ccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262548

Nc1nccc2ccc(cc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM368123

Nc1ncccc1-c1cc(ccn1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM368032

Nc1ncccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM361156

Nc1ncccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@@H]1CNCCN1 |r|

BDBM361159

Nc1ncccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)NC[C@H]1CNCCN1 |r|

BDBM361052

Nc1ncccc1-c1ccc(c(c1-c1nn[nH]n1)S(N)(=O)=O)S(=O)(=O)N[C@@H]1CCNC1

BDBM262896

Nc1ncnc2cc(ccc12)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM368157

Nc1nnc(o1)-c1cccc(c1)-c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)S(=O)(=O)C1CNC1

BDBM262911

Nc1nnc(s1)C1CCN(CC1)c1ccc(c(c1-c1nnn[nH]1)S(N)(=O)=O)C(F)(F)F

BDBM262364

Nc1nnc(s1)C1CCN(CC1)c1ccnc(c1-c1nnn[nH]1)S(N)(=O)=O

BDBM50174230

O=C(CSc1nnc([nH]1)-c1ccccc1)Nc1ccccc1

BDBM50270755

O=C(Nc1c(C#N)c(c(-c2ccccc2)n1Cc1ccccc1)-c1ccccc1)c1ccc(cc1)C(=O)c1ccccc1

BDBM50270748

O=C(Nc1c(C#N)c(c(-c2ccccc2)n1Cc1ccccc1)-c1ccccc1)c1ccccc1

BDBM50131078

O=Cc1coc2ccccc2c1=O

BDBM50129065

O=c1c(coc2ccccc12)C#N

BDBM367841

OB(O)c1cccc2[nH]cnc12

BDBM50488271

OC(=O)C(NC(=O)C(CS)CCc1ccccc1)c1ccc(CN2NNN=C2)s1 |c:27|

BDBM50271836

OC(=O)C(S)Cc1ccccc1

BDBM50271834

OC(=O)C(S)c1ccccc1

BDBM50271833

OC(=O)C(\S)=C\c1c(Cl)ccc(Cl)c1Cl

BDBM50271847

OC(=O)C(\S)=C\c1c(Cl)cccc1Cl

BDBM50271952

OC(=O)C(\S)=C\c1c(F)ccc(F)c1F

BDBM50271950

OC(=O)C(\S)=C\c1c(F)cccc1Cl

BDBM50271878

OC(=O)C(\S)=C\c1c(F)cccc1F

BDBM50271892

OC(=O)C(\S)=C\c1c2ccccc2cc2ccccc12

BDBM50271876

OC(=O)C(\S)=C\c1cc(Cl)ccc1Cl

BDBM50271903

OC(=O)C(\S)=C\c1ccc(Br)cc1

BDBM50271846

OC(=O)C(\S)=C\c1ccc(F)cc1

BDBM50271868

OC(=O)C(\S)=C\c1cccc(Cl)c1Cl

BDBM50271835

OC(=O)C(\S)=C\c1ccccc1

BDBM50271936

OC(=O)C(\S)=C\c1ccccc1Br

BDBM50271893

OC(=O)C(\S)=C\c1ccccc1Cc1ccc2ccccc2c1

BDBM50271798

OC(=O)C(\S)=C\c1ccccc1Cl

BDBM50271922

OC(=O)C(\S)=C\c1ccccc1F

BDBM50271938

OC(=O)C(\S)=C\c1ccccc1I

BDBM50271802

OC(=O)C(\S)=C\c1csc2ccccc12

BDBM50129081

OC(=O)CCCc1c[nH]c2ccccc12

BDBM50271890

OC(=O)CN1C(=S)S\C(=C/c2c(Cl)ccc(Cl)c2Cl)C1=O

BDBM50271962

OC(=O)CN1C(=S)S\C(=C/c2c(Cl)cccc2Cl)C1=O

BDBM50271951

OC(=O)CN1C(=S)S\C(=C/c2c(F)ccc(F)c2F)C1=O

BDBM50271949

OC(=O)CN1C(=S)S\C(=C/c2c(F)cccc2Cl)C1=O

BDBM50271877

OC(=O)CN1C(=S)S\C(=C/c2c(F)cccc2F)C1=O

BDBM50271874

OC(=O)CN1C(=S)S\C(=C/c2cc(Cl)ccc2Cl)C1=O

BDBM50271901

OC(=O)CN1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O

BDBM50271844

OC(=O)CN1C(=S)S\C(=C/c2ccc(F)cc2)C1=O

BDBM50271866

OC(=O)CN1C(=S)S\C(=C/c2cccc(Cl)c2Cl)C1=O

BDBM50092287

OC(=O)CN1C(=S)S\C(=C/c2ccccc2)C1=O

BDBM50271934

OC(=O)CN1C(=S)S\C(=C/c2ccccc2Br)C1=O

BDBM50271923

OC(=O)CN1C(=S)S\C(=C/c2ccccc2Cl)C1=O

BDBM50271920

OC(=O)CN1C(=S)S\C(=C/c2ccccc2F)C1=O

BDBM50271799

OC(=O)CN1C(=S)S\C(=C/c2ccccc2I)C1=O

BDBM28898

OC(=O)CN1C(=S)S\C(=C/c2csc3ccccc23)C1=O

BDBM50452815

OC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CC1

BDBM114408

OC(=O)CSc1ccnc2cc(Cl)ccc12

BDBM50488264

OC(=O)[C@@H](Cc1ccc2OCOc2c1)[C@H](Cc1ccc2OCOc2c1)C(O)=O |r|

BDBM50081025

OC(=O)[C@@H](Cc1ccc2oc3ccccc3c2c1)SC(=O)c1ccccc1

BDBM50081057

OC(=O)[C@@H](Cc1ccccc1)SC(=O)c1ccccc1

BDBM50488255

OC(=O)[C@@H](Cc1ccccc1)[C@H](Cc1ccc2OCOc2c1)C(O)=O |r|

BDBM50488290

OC(=O)[C@@H](Cc1ccccc1)[C@H](Cc1ccccc1)C(O)=O |r|

BDBM50488289

OC(=O)[C@@H](S)Cc1ccc(cc1)-c1ccccc1

BDBM50488256

OC(=O)[C@@H](S)Cc1ccc2oc3ccccc3c2c1

BDBM50174264

OC(=O)[C@@H](S)c1ccccc1 |r|

BDBM50488262

OC(=O)[C@H](Cc1ccccc1)SC(=O)c1ccccc1

BDBM50488285

OC(=O)[C@H](Cc1ccccc1)[C@@H](Cc1ccccc1)C(O)=O |r|

BDBM50081056

OC(=O)[C@H](S)Cc1ccc(cc1)-c1ccccc1

BDBM50081042

OC(=O)[C@H](S)Cc1ccc2oc3ccccc3c2c1

BDBM50081016

OC(=O)[C@H](S)Cc1ccccc1

BDBM50174303

OC(=O)[C@H](S)c1ccccc1 |r|

BDBM26116

OC(=O)c1cccc(n1)C(O)=O

BDBM50021959

OC\C=C1/O[C@@H]2CC(=O)N2[C@H]1C(O)=O |r|

BDBM50322611

OP(O)(=O)c1cc(F)ccc1S

BDBM50322606

OP(O)(=O)c1ccccc1CS

BDBM50322604

OP(O)(=O)c1ccccc1S

BDBM50322600

OP(O)(O)C(=S)c1ccc(Br)cc1

BDBM50322601

OP(O)(O)C(=S)c1ccc(Cl)cc1

BDBM50322612

OP(O)(O)C(=S)c1ccc(Cl)cc1Cl

BDBM50322602

OP(O)(O)C(=S)c1ccc(F)cc1

BDBM50322610

OP(O)(O)C(=S)c1ccccc1

BDBM50008094

OS(O)([O-])CC[NH+]1CCOCC1

BDBM50174175

Oc1ccc(cc1)-c1nnc(SCC(=O)Nc2cccc(Cl)c2)[nH]1

BDBM50174184

Oc1ccc(cc1)-c1nnc(SCC(=O)Nc2ccccc2)[nH]1

BDBM50174305

Oc1ccc(cc1)-c1nnc(SCC(=O)Nc2ccccc2Cl)[nH]1

BDBM50174182

Oc1ccccc1-c1nnc(SCC(=O)Nc2cccc(Cl)c2)[nH]1

BDBM50174192

Oc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2)[nH]1

BDBM50174185

Oc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2Cl)[nH]1

BDBM50484529

Sc1nnc([nH]1)-c1ccc(cc1)C(=O)c1ccccc1

BDBM50570711

[#6]-[#7](-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1)-[#6](=S)-[#7]\[#7]=[#6](\c1ccccn1)-c1ccccn1

BDBM50484376

[#6]-[#8]-c1ccc(cc1)-n1c2-[#7]=[#6]-[#7]\[#6](=[#6](\C#N)C#N)-c2c(c1-c1ccccc1)-c1ccccc1 |c:11|

BDBM50548231

[#6]C([#6])([#6])[#8]-[#6](=O)-[#7]-[#6]-[#6]-n1[se;v2]c2ccccc2c1=O

BDBM50212637

[H][C@@]12CC(=O)N1[C@@H](C(O)=O)[C@](C)(CSC1=NCCS1)S2(=O)=O |t:15|

BDBM50212646

[H][C@@]12CC(=O)N1[C@@H](C(O)=O)[C@](C)(CSc1nc3ccccc3[nH]1)S2(=O)=O

BDBM50212634

[H][C@@]12CC(=O)N1[C@@H](C(O)=O)[C@](C)(CSc1nc3ccccc3o1)S2(=O)=O

BDBM50212639

[H][C@@]12CC(=O)N1[C@@H](C(O)=O)[C@](C)(CSc1nccn1C)S2(=O)=O

BDBM50212640

[H][C@@]12CC(=O)N1[C@@H](C(O)=O)[C@](C)(CSc1nncn1C)S2(=O)=O

BDBM50212638

[H][C@@]12CC(=O)N1[C@@H](C(O)=O)[C@](C)(CSc1nnnn1C)S2(=O)=O

BDBM50129062

[H][C@]1([C@@H](C)O)C(=O)N2C(C(O)=O)=C(S[C@@H]3CN[C@@H](C3)C(=O)N(C)C)[C@H](C)[C@]12[H] |r,t:11|

BDBM50212641

[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2Br)C(O)=O

BDBM50212636

[H][C@]12S[C@@](C)(CSC3=NCCS3)[C@@H](N1C(=O)[C@H]2Br)C(O)=O |t:7|

BDBM50212642

[H][C@]12S[C@@](C)(CSc3nc4ccccc4o3)[C@@H](N1C(=O)[C@H]2Br)C(O)=O

BDBM50212643

[H][C@]12S[C@@](C)(CSc3nc4ccccc4s3)[C@@H](N1C(=O)[C@H]2Br)C(O)=O

BDBM50212645

[H][C@]12S[C@@](C)(CSc3nc[nH]n3)[C@@H](N1C(=O)[C@H]2Br)C(O)=O

BDBM50212644

[H][C@]12S[C@@](C)(CSc3nccn3C)[C@@H](N1C(=O)[C@H]2Br)C(O)=O

BDBM50212635

[H][C@]12S[C@@](C)(CSc3nnnn3C)[C@@H](N1C(=O)[C@H]2Br)C(O)=O

BDBM50452814

[Na;v0+].[Na;v0+].[Na;v0+].[#16-]-[#6](=S)-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6](-[#16-])=S)-[#6](-[#16-])=S

BDBM50157693

[Na]OC(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cn2c(n1)sc1cc(Cl)ccc21 |r,t:4|

BDBM50157689

[Na]OC(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cn2c(n1)sc1ccccc21 |r,t:4|

BDBM50191380

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C/c1cn2CCNCc2n1 |t:3|

BDBM50191378

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C/c1cn2CCOCc2n1 |t:3|

BDBM50191384

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C/c1cn2CCSCc2n1 |t:3|

BDBM50191386

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2CCCCn2n1 |t:3|

BDBM50149466

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2CCCn2n1 |t:3|

BDBM50191389

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2CN(CCc2s1)c1cc2COCCc2s1 |t:3|

BDBM50191382

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2CN(Cc3cccnc3)CCc2s1 |t:3|

BDBM50191377

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2CNCCn2n1 |t:3|

BDBM50191385

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2COCCn2n1 |t:3|

BDBM50191390

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2CS(=O)(=O)CCn2n1 |t:3|

BDBM50191379

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2CSCCn2n1 |t:3|

BDBM50191388

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cc2OCCCn2n1 |t:3|

BDBM50191383

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cn2CCSCc2n1 |t:3|

BDBM50149467

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cn2c3CCCc3sc2n1 |t:3|

BDBM50149469

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cnc2CNCCn12 |t:3|

BDBM50149468

[O-]C(=O)C1=CS[C@H]2N1C(=O)\C2=C\c1cnc2COCCn12 |t:3|