SMILES for Fatty acid-binding protein, adipocyte

655 SMILES Strings for Fatty acid-binding protein, adipocyte

Compound Name

SMILES String

BDBM50319697

C(Sc1nc2ccccc2[nH]1)c1cccc(CSc2nc3ccccc3[nH]2)n1

BDBM50590451

C=CCn1c2cc([nH]c2c(=O)[nH]c1=O)-c1ccc(OCCNC(=O)c2ccccc2)cc1

BDBM451168

CC(C)(C)c1ccc(cc1)-n1nc(cc1-c1ccccc1)-c1ccccc1OCCCC(O)=O

BDBM312273

CC(C)(C)c1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCCc12 |t:15,(3.05,3.91,;1.72,4.68,;.95,6.02,;2.49,6.02,;.38,3.91,;-1.08,4.39,;-1.99,3.14,;-1.08,1.9,;.38,2.37,;-1.85,.56,;-.95,-.68,;.59,-.68,;1.36,-2.02,;.59,-3.35,;2.9,-2.02,;3.67,-3.35,;5.21,-3.35,;5.98,-2.02,;5.21,-.68,;3.67,-.68,;4.07,-2.17,;4.82,-1.86,;2.9,-4.68,;1.36,-4.68,;3.67,-6.02,;-1.85,-1.93,;-3.32,-1.45,;-4.65,-2.22,;-5.98,-1.45,;-5.98,.09,;-4.65,.86,;-3.32,.09,)|

BDBM312274

CC(C)(C)c1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCCc12 |t:15|

BDBM50212880

CC(C)Cn1c(nc(c1-c1ccccc1)-c1ccccc1)-c1ccccc1-c1cccc(NCC(O)=O)c1

BDBM50590445

CC(C)OC(=O)C(C(=O)C(F)(F)F)c1cc(NS(=O)(=O)c2ccccc2)ccc1O

BDBM50177675

CC(C)Oc1cccc(c1)-c1c(-c2c(C)n[nH]c2C)c2cc(ccc2n1CCC(O)=O)C1CC1 |(9.68,3.39,;8.99,2.37,;9.53,1.26,;7.45,2.48,;6.59,1.2,;7.27,-.19,;6.41,-1.46,;4.87,-1.36,;4.2,.03,;5.05,1.3,;2.66,.02,;1.76,-1.24,;2.24,-2.7,;3.66,-3.26,;4.7,-2.6,;3.55,-4.79,;2.05,-5.16,;1.24,-3.85,;.01,-3.75,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.24,2.7,;3.75,3.01,;4.23,4.48,;3.41,5.4,;5.43,4.73,;-3.71,-1.53,;-4.4,-2.82,;-5.17,-1.49,)|

BDBM50063855

CC(C)c1cc(C(C)C)c(C(O)=O)c(c1)C(C)C

BDBM50063851

CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)n1c(C)nc2cc(Cl)ccc12

BDBM50063858

CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)n1c(C)nc2ccc(Br)cc12

BDBM50063857

CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)n1c(C)nc2ccccc12

BDBM50063856

CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)n1ccnc1

BDBM50063859

CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)n1cnc2ccc(Br)cc12

BDBM50063852

CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)n1cnc2ccc(N)cc12

BDBM50063853

CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(N)(=O)=O

BDBM50063854

CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(O)(=O)=O

BDBM50429942

CC(C)c1ccc(cc1)-n1nc(cc1-c1ccccc1)-c1ccccc1OCCCC(O)=O

BDBM451178

CC(C)c1ccc(cc1)-n1nc(cc1-c1ccccc1Br)-c1cc(F)ccc1OCCCC(O)=O

BDBM451176

CC(C)c1ccc(cc1)-n1nc(cc1-c1ccccc1Cl)-c1cc(F)ccc1OCCCC(O)=O

BDBM50197088

CC(C)c1cccc(c1)-c1c(C(O)=O)c(nc2ccc(Cl)cc12)N(C)C

BDBM50574777

CC(C)c1ccccc1-c1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM312486

CC(C)c1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CC(F)(F)CCc12 |t:14,(1.47,6.33,;1.87,4.84,;3.36,4.44,;.78,3.75,;-.68,4.23,;-1.59,2.98,;-.68,1.74,;.78,2.21,;-1.08,.25,;-.18,-1,;1.36,-1,;2.13,-2.33,;1.36,-3.66,;3.67,-2.33,;4.44,-3.66,;5.98,-3.66,;6.75,-2.33,;5.98,-1,;4.44,-1,;5.78,-1.77,;4.69,-2.85,;3.67,-5,;2.13,-5,;4.44,-6.33,;-1.08,-2.24,;-2.55,-1.77,;-3.88,-2.54,;-5.21,-1.77,;-6.75,-1.77,;-5.98,-3.1,;-5.21,-.23,;-3.88,.54,;-2.55,-.23,)|

BDBM312485

CC(C)c1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CC(F)(F)CCc12 |t:14|

BDBM312487

CC(C)c1csc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CC(F)(F)CCc12 |t:14|

BDBM50197092

CC(C)c1nc2ccc(Cl)cc2c(-c2ccccc2)c1C(O)=O

BDBM312320

CC(C)c1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCCc12 |t:14,(2.96,4.37,;1.47,4.77,;1.07,6.25,;.38,3.68,;-1.08,4.15,;-1.99,2.91,;-1.08,1.66,;.38,2.14,;-1.85,.33,;-.95,-.92,;.59,-.92,;1.36,-2.25,;.59,-3.59,;2.9,-2.25,;3.67,-3.59,;5.21,-3.59,;5.98,-2.25,;5.21,-.92,;3.67,-.92,;4.07,-2.41,;4.82,-2.1,;2.9,-4.92,;1.36,-4.92,;3.67,-6.25,;-1.85,-2.16,;-3.32,-1.69,;-4.65,-2.46,;-5.98,-1.69,;-5.98,-.15,;-4.65,.62,;-3.32,-.15,)|

BDBM312322

CC(C)c1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2COCCc12 |t:14,(1.49,4.65,;.01,5.05,;-.39,6.53,;-1.08,3.96,;-2.62,3.96,;-3.1,2.49,;-1.85,1.59,;-.61,2.49,;-1.85,.05,;-.95,-1.2,;.59,-1.2,;1.36,-2.53,;.59,-3.87,;2.9,-2.53,;3.67,-3.87,;5.21,-3.87,;5.98,-2.53,;5.21,-1.2,;3.67,-1.2,;4.07,-2.69,;4.82,-2.38,;2.9,-5.2,;1.36,-5.2,;3.67,-6.53,;-1.85,-2.44,;-3.32,-1.97,;-4.65,-2.74,;-5.98,-1.97,;-5.98,-.43,;-4.65,.34,;-3.32,-.43,)|

BDBM312319

CC(C)c1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCCc12 |t:14|

BDBM312321

CC(C)c1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2COCCc12 |t:14|

BDBM312327

CC(C)c1noc(n1)-c1c(NC(=O)[C@H]2CCCC[C@@H]2C(O)=O)sc2COCCc12 |r|

BDBM312328

CC(C)c1noc(n1)-c1c(NC(=O)[C@H]2CCCC[C@H]2C(O)=O)sc2COCCc12 |r|

BDBM312472

CC1(C)CC(C(O)=O)=C(C1)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |c:7|

BDBM312357

CC1(C)CCCc2sc(NC(=O)C3=C(C4CCC3CC4)C(O)=O)c(-c3nc(no3)C3CC3)c12 |t:12,(-5.42,2.19,;-4.65,.86,;-3.88,2.19,;-5.98,.09,;-5.98,-1.45,;-4.65,-2.22,;-3.32,-1.45,;-1.85,-1.93,;-.95,-.68,;.59,-.68,;1.36,-2.02,;.59,-3.35,;2.9,-2.02,;3.67,-3.35,;5.21,-3.35,;5.98,-2.02,;5.21,-.68,;3.67,-.68,;4.07,-2.17,;4.82,-1.86,;2.9,-4.68,;1.36,-4.68,;3.67,-6.02,;-1.85,.56,;-1.08,1.9,;.38,2.37,;.38,3.91,;-1.08,4.39,;-1.99,3.14,;1.72,4.68,;3.26,4.68,;2.49,6.02,;-3.32,.09,)|

BDBM312356

CC1(C)CCCc2sc(NC(=O)C3=C(CCC3)C(O)=O)c(-c3nc(no3)C3CC3)c12 |t:12|

BDBM312492

CC1(C)CCc2sc(NC(=O)C3=C(C4CCC3CC4)C(O)=O)c(-c3nc(no3)C3CC3)c2C1 |t:11,(-6.65,.54,;-5.32,-.23,;-6.65,-1,;-5.32,-1.77,;-3.98,-2.54,;-2.65,-1.77,;-1.18,-2.24,;-.28,-1,;1.26,-1,;2.03,-2.33,;1.26,-3.66,;3.57,-2.33,;4.34,-3.66,;5.88,-3.66,;6.65,-2.33,;5.88,-1,;4.34,-1,;5.67,-1.77,;4.59,-2.85,;3.57,-5,;2.03,-5,;4.34,-6.33,;-1.18,.25,;-.79,1.74,;.68,2.21,;.68,3.75,;-.79,4.23,;-1.69,2.98,;1.77,4.84,;3.25,5.24,;2.17,6.33,;-2.65,-.23,;-3.98,.54,)|

BDBM312490

CC1(C)CCc2sc(NC(=O)C3=C(CCC3)C(O)=O)c(-c3nc(no3)C3CC3)c2C1 |t:11|

BDBM312275

CC1(C)CCc2sc(NC(=O)C3=C(CCC3)C(O)=O)c(c2C1)-c1ncccn1 |t:11|

BDBM312491

CC1(C)CCc2sc(NC(=O)C3=C(CCCC3)C(O)=O)c(-c3nc(no3)C3CC3)c2C1 |t:11|

BDBM312259

CC1(C)COC(=N1)c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCCc12 |c:5,t:13|

BDBM312352

CC1(C)Cc2c(CO1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(no1)C1CC1 |t:14,(-6.65,.86,;-5.32,.09,;-6.65,-.68,;-3.98,.86,;-2.65,.09,;-2.65,-1.45,;-3.98,-2.22,;-5.32,-1.45,;-1.18,-1.93,;-.28,-.68,;1.26,-.68,;2.03,-2.02,;1.26,-3.35,;3.57,-2.02,;4.34,-3.35,;5.88,-3.35,;6.65,-2.02,;5.88,-.68,;4.34,-.68,;5.67,-1.45,;4.55,-2.58,;3.57,-4.68,;2.03,-4.68,;4.34,-6.02,;-1.18,.56,;-.41,1.9,;1.05,2.37,;1.05,3.91,;-.41,4.39,;-1.32,3.14,;2.38,4.68,;3.92,4.68,;3.15,6.02,)|

BDBM312336

CC1(C)Cc2c(CO1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:14|

BDBM312337

CC1(C)Cc2c(CO1)sc(NC(=O)C1=C(CCCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:14|

BDBM312310

CC1(C)OC(C)(C)c2c1sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:15|

BDBM263038

CC1(CCCN1C(=O)Nc1ccccc1-c1ccccc1)C(O)=O

BDBM312477

CC1(O)CCc2c(C1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(no1)C1CC1 |t:14,(-6.65,-2.54,;-5.32,-1.77,;-6.65,-1,;-5.32,-.23,;-3.98,.54,;-2.65,-.23,;-2.65,-1.77,;-3.98,-2.54,;-1.18,-2.24,;-.28,-1,;1.26,-1,;2.03,-2.33,;1.26,-3.66,;3.57,-2.33,;4.34,-3.66,;5.88,-3.66,;6.65,-2.33,;5.88,-1,;4.34,-1,;5.64,-1.8,;4.55,-2.89,;3.57,-5,;2.03,-5,;4.34,-6.33,;-1.18,.25,;-.79,1.74,;.68,2.21,;.68,3.75,;-.79,4.23,;-1.69,2.98,;1.77,4.84,;3.25,5.24,;2.17,6.33,)|

BDBM312476

CC1(O)CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:14|

BDBM312478

CC1(O)CCc2c(C1)sc(NC(=O)C1=C(CCCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:14|

BDBM312347

CC1CCc2c(C1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(no1)C1CC1 |t:13,(-6.65,-2.22,;-5.32,-1.45,;-5.32,.09,;-3.98,.86,;-2.65,.09,;-2.65,-1.45,;-3.98,-2.22,;-1.18,-1.93,;-.28,-.68,;1.26,-.68,;2.03,-2.02,;1.26,-3.35,;3.57,-2.02,;4.34,-3.35,;5.88,-3.35,;6.65,-2.02,;5.88,-.68,;4.34,-.68,;5.67,-1.45,;4.55,-2.58,;3.57,-4.68,;2.03,-4.68,;4.34,-6.02,;-1.18,.56,;-.41,1.9,;1.05,2.37,;1.05,3.91,;-.41,4.39,;-1.32,3.14,;2.38,4.68,;3.92,4.68,;3.15,6.02,)|

BDBM312342

CC1CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:13|

BDBM312346

CC1CCc2c(C1)sc(NC(=O)C1=C(CCCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:13|

BDBM50346465

CCC(Oc1cccc(c1)-c1ccccc1-c1cc(-c2cccs2)n(n1)-c1ccc(Cl)cc1)C(O)=O

BDBM312433

CCC1CCc2c(C1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(C)cs1 |t:14,(-7.32,-.79,;-5.98,-1.56,;-4.65,-.79,;-4.65,.75,;-3.32,1.52,;-1.98,.75,;-1.98,-.79,;-3.32,-1.56,;-.52,-1.26,;.39,-.02,;1.93,-.02,;2.7,-1.35,;1.93,-2.68,;4.24,-1.35,;5.01,-2.68,;6.55,-2.68,;7.32,-1.35,;6.55,-.02,;5.01,-.02,;6.01,-1.1,;5.42,-1.68,;4.24,-4.02,;2.7,-4.02,;5.01,-5.35,;-.52,1.23,;.25,2.56,;1.72,3.04,;1.72,4.58,;3.05,5.35,;.25,5.06,;-.65,3.81,)|

BDBM312423

CCC1CCc2c(C1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(no1)C1CC1 |t:14,(-7.32,-1.45,;-5.98,-2.22,;-4.65,-1.45,;-4.65,.09,;-3.32,.86,;-1.98,.09,;-1.98,-1.45,;-3.32,-2.22,;-.52,-1.93,;.39,-.68,;1.93,-.68,;2.7,-2.02,;1.93,-3.35,;4.24,-2.02,;5.01,-3.35,;6.55,-3.35,;7.32,-2.02,;6.55,-.68,;5.01,-.68,;6.34,-1.45,;5.25,-2.54,;4.24,-4.68,;2.7,-4.68,;5.01,-6.02,;-.52,.56,;.25,1.9,;1.72,2.37,;1.72,3.91,;.25,4.39,;-.65,3.14,;3.05,4.68,;4.59,4.68,;3.82,6.02,)|

BDBM312436

CCC1CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(C)cs1 |t:14|

BDBM312420

CCC1CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:14|

BDBM312447

CCC1CCc2c(C1)sc(NC(=O)C1=C(CCCC1)C(O)=O)c2-c1nc(C)cs1 |t:14|

BDBM312446

CCC1CCc2c(C1)sc(NC(=O)C1=C(CCCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:14|

BDBM50152850

CCCCCCCCCCCCCCCC(O)=O

BDBM50240485

CCCCCCCCCCCCCCCCCC(O)=O

BDBM50525625

CCCCCCCCCCCCOc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM50525616

CCCCCCCCCCOc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM50525624

CCCCCCCCOc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM50150484

CCCCCCCC\C=C/CCCCCCCC(O)=O

BDBM50250904

CCCCCCCC\C=C\CCCCCCCC(O)=O

BDBM50525623

CCCCCCCOc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM50525633

CCCCCCOc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM50525622

CCCCCOc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM22231

CCCCC\C=C/C\C=C/CCCCCCCC(O)=O

BDBM22319

CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O

BDBM50187495

CCCOc1cc(ccc1Cl)S(=O)(=O)Nc1ccc(cc1)C(O)=O

BDBM50247992

CCCn1c2CCCCCc2c2cccc(C(O)=O)c12

BDBM50247991

CCCn1c2CCCCc2c2cccc(C(O)=O)c12

BDBM50538227

CCNc1ccc(Nc2ccccc2C(O)=O)c(c1Cl)-c1ccccc1

BDBM312502

CCOC(=O)c1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CC(F)(F)CCc12 |t:16|

BDBM234688

CCOC(=O)c1sc(NC(=O)C2=C(CCC2)C(O)=O)c(c1C)-c1nc(no1)C1CC1 |t:11|

BDBM50187491

CCOc1cc(\C=C2\SC(=S)N(CCC(O)=O)C2=O)ccc1O

BDBM50525621

CCOc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM312435

CC[C@@H]1CCc2c(C1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(C)cs1 |r,wD:2.1,t:14,(-6.9,-9.95,;-5.56,-10.72,;-4.23,-9.95,;-4.23,-8.41,;-2.9,-7.64,;-1.56,-8.41,;-1.56,-9.95,;-2.9,-10.72,;-.1,-10.43,;.81,-9.18,;2.35,-9.18,;3.12,-10.52,;2.35,-11.85,;4.66,-10.52,;5.43,-11.85,;6.97,-11.85,;7.74,-10.52,;6.97,-9.18,;5.43,-9.18,;6.43,-10.27,;5.84,-10.85,;4.66,-13.18,;3.12,-13.18,;5.43,-14.52,;-.1,-7.94,;.67,-6.6,;2.14,-6.13,;2.14,-4.59,;3.47,-3.82,;.67,-4.11,;-.23,-5.36,)|

BDBM312425

CC[C@@H]1CCc2c(C1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(no1)C1CC1 |r,wD:2.1,t:14,(-6.89,-8.62,;-5.56,-9.39,;-4.23,-8.62,;-4.23,-7.08,;-2.89,-6.31,;-1.56,-7.08,;-1.56,-8.62,;-2.89,-9.39,;-.09,-9.09,;.81,-7.85,;2.35,-7.85,;3.12,-9.18,;2.35,-10.51,;4.66,-9.18,;5.43,-10.51,;6.97,-10.51,;7.74,-9.18,;6.97,-7.85,;5.43,-7.85,;6.76,-8.62,;5.68,-9.71,;4.66,-11.85,;3.12,-11.85,;5.43,-13.18,;-.09,-6.6,;.68,-5.27,;2.14,-4.79,;2.14,-3.25,;.68,-2.78,;-.23,-4.02,;3.47,-2.48,;5.01,-2.48,;4.24,-1.15,)|

BDBM312438

CC[C@@H]1CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(C)cs1 |r,t:14|

BDBM312422

CC[C@@H]1CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |r,t:14|

BDBM312434

CC[C@H]1CCc2c(C1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(C)cs1 |r,wU:2.1,t:14,(-6.9,-9.95,;-5.56,-10.72,;-4.23,-9.95,;-4.23,-8.41,;-2.9,-7.64,;-1.56,-8.41,;-1.56,-9.95,;-2.9,-10.72,;-.1,-10.43,;.81,-9.18,;2.35,-9.18,;3.12,-10.52,;2.35,-11.85,;4.66,-10.52,;5.43,-11.85,;6.97,-11.85,;7.74,-10.52,;6.97,-9.18,;5.43,-9.18,;6.43,-10.27,;5.84,-10.85,;4.66,-13.18,;3.12,-13.18,;5.43,-14.52,;-.1,-7.94,;.67,-6.6,;2.14,-6.13,;2.14,-4.59,;3.47,-3.82,;.67,-4.11,;-.23,-5.36,)|

BDBM312424

CC[C@H]1CCc2c(C1)sc(NC(=O)C1=C(C3CCC1CC3)C(O)=O)c2-c1nc(no1)C1CC1 |r,wU:2.1,t:14,(-6.89,-8.62,;-5.56,-9.39,;-4.23,-8.62,;-4.23,-7.08,;-2.89,-6.31,;-1.56,-7.08,;-1.56,-8.62,;-2.89,-9.39,;-.09,-9.09,;.81,-7.85,;2.35,-7.85,;3.12,-9.18,;2.35,-10.51,;4.66,-9.18,;5.43,-10.51,;6.97,-10.51,;7.74,-9.18,;6.97,-7.85,;5.43,-7.85,;6.76,-8.62,;5.68,-9.71,;4.66,-11.85,;3.12,-11.85,;5.43,-13.18,;-.09,-6.6,;.68,-5.27,;2.14,-4.79,;2.14,-3.25,;.68,-2.78,;-.23,-4.02,;3.47,-2.48,;5.01,-2.48,;4.24,-1.15,)|

BDBM312437

CC[C@H]1CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(C)cs1 |r,t:14|

BDBM312421

CC[C@H]1CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |r,t:14|

BDBM50212873

CCc1c(c(nn1-c1ccccc1-c1cccc(OCC(O)=O)c1)-c1ccccc1)-c1ccccc1

BDBM50212875

CCc1c(c(nn1-c1ccccc1-c1cccc(c1)C(O)=O)-c1ccccc1)-c1ccccc1

BDBM50212882

CCc1c(c(nn1-c1ccccc1-c1cccc(c1)C(O)C(O)=O)-c1ccccc1)-c1ccccc1 |w:19.22|

BDBM50468360

CCc1c(c(nn1-c1ccccc1-c1ccccc1OCC(O)=O)-c1ccccc1)-c1ccccc1

BDBM50212886

CCc1c(oc(c1-c1ccccc1)-c1ccccc1)-c1ccccc1-c1cccc(OCC(O)=O)c1

BDBM50152897

CCc1cc(=O)[nH]c(NCc2ccc(Cl)cc2)n1

BDBM263069

CCc1ccc(c(NC(=O)N2CCC[C@@H]2C(O)=O)c1)-c1ccccc1 |r|

BDBM50574788

CCc1ccccc1-c1cc(c2ccccc2c1OC)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1

BDBM312292

CCc1noc(n1)-c1c2CCCCc2sc1NC(=O)C1=C(CCC1)C(O)=O |t:22|

BDBM50212877

CCn1c(nc(c1-c1ccccc1)-c1ccccc1)-c1ccccc1-c1cccc(NCC(O)=O)c1

BDBM50212884

CCn1c(nc(c1-c1ccccc1)-c1ccccc1)-c1ccccc1-c1cccc(OCC(O)=O)c1

BDBM212446

CN(C(=O)Nc1ccccc1-c1ccccc1)C1(CC1)C(O)=O

BDBM234689

CN(C)C(=O)c1sc(NC(=O)C2=C(CCC2)C(O)=O)c(c1C)-c1nc(no1)C1CC1 |t:11|

BDBM50538226

CN(C)c1ccc(Nc2ccccc2C(O)=O)c(-c2ccccc2)c1Cl

BDBM234695

CN(C)c1nc(ns1)-c1sc(NC(=O)C2=C(CCC2)C(O)=O)c(c1C)-c1nc(no1)C1CC1 |t:15|

BDBM50152886

CN(Cc1ccc(Cl)cc1)c1nc(cc(=O)[nH]1)C(F)(F)F

BDBM50152878

CN(Cc1ccccc1)c1nc(cc(=O)[nH]1)C(F)(F)F

BDBM50538237

CNc1ccc(Nc2ccccc2C(O)=O)c(c1Cl)-c1ccc2OCCc2c1

BDBM50538231

CNc1ccc(Nc2ccccc2C(O)=O)c(c1Cl)-c1ccccc1

BDBM312366

COC(=O)[C@@]12C[C@@]1(CCC2)C(=O)Nc1sc2CCCCc2c1-c1nc(C)no1 |r|

BDBM50319702

COC(=O)c1cc(OC)c(OC)cc1NC(=O)CSCC(O)=O

BDBM234670

COC(=O)c1sc(NC(=O)C2=C(C3CCC2CC3)C(O)=O)c(c1C)-c1nc(C)cs1 |t:10,(-6.65,-1.56,;-5.32,-.79,;-3.98,-1.56,;-3.98,-3.1,;-2.65,-.79,;-1.18,-1.26,;-.28,-.02,;1.26,-.02,;2.03,-1.35,;1.26,-2.68,;3.57,-1.35,;4.34,-2.68,;5.93,-2.68,;6.65,-1.35,;5.88,-.02,;4.34,-.02,;4.88,-1.53,;5.93,-1.53,;3.57,-4.02,;2.03,-4.02,;4.34,-5.35,;-1.18,1.23,;-2.65,.75,;-3.98,1.52,;-.41,2.56,;1.05,3.04,;1.05,4.58,;2.38,5.35,;-.41,5.06,;-1.32,3.81,)|

BDBM50310988

COC(=O)c1sc(cc1NC(=O)\C=C\C(O)=O)-c1cccs1

BDBM50192465

COC(C(O)=O)c1cccc(OCc2ccccc2Cl)c1OCc1ccccc1Cl

BDBM312494

COC1(C)CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |t:15|

BDBM312289

COC1CCc2c(C1)sc(NC(=O)C1CC=CCC1C(O)=O)c2-c1nc(C)cs1 |c:16|

BDBM312302

COC1CCc2c(C1)sc(NC(=O)C1CCCCC1C(O)=O)c2-c1nc(C)cs1

BDBM312365

COCCc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2COCCc12 |t:15,(5.72,4.58,;4.38,5.35,;3.05,4.58,;1.72,5.35,;.38,4.58,;-1.08,5.06,;-1.99,3.81,;-1.08,2.56,;.38,3.04,;-1.85,1.23,;-.95,-.02,;.59,-.02,;1.36,-1.35,;.59,-2.68,;2.9,-1.35,;3.67,-2.68,;5.21,-2.68,;5.98,-1.35,;5.21,-.02,;3.67,-.02,;4.07,-1.5,;4.82,-1.2,;2.9,-4.02,;1.36,-4.02,;3.67,-5.35,;-1.85,-1.26,;-3.32,-.79,;-4.65,-1.56,;-5.98,-.79,;-5.98,.75,;-4.65,1.52,;-3.32,.75,)|

BDBM312364

COCCc1noc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2COCCc12 |t:15|

BDBM312373

COCCc1noc(n1)-c1c2CCOCc2sc1NC(=O)C1=C(CCC1)C(O)=O |t:24|

BDBM312498

CO[C@@]1(C)CCc2c(C1)sc(NC(=O)C1=C(CCC1)C(O)=O)c2-c1nc(no1)C1CC1 |r,t:15|

BDBM50574792

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccc(F)c(Cl)c1

BDBM50574784

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccc(F)cc1

BDBM50574783

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccc(F)cc1C

BDBM50574791

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccc(F)cc1Cl

BDBM50574790

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccc(F)cc1F

BDBM50574793

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1cccc(Cl)c1F

BDBM50574787

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccccc1C

BDBM50574786

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccccc1Cl

BDBM50574785

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccccc1F

BDBM50574789

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(CC(O)=O)c1)-c1ccccc1O

BDBM50525637

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccc(Cl)c(Cl)c1

BDBM50525631

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccc(F)c(Cl)c1

BDBM50525620

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccc(F)c(F)c1

BDBM50525630

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccc(F)cc1

BDBM50574794

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccc(F)cc1C

BDBM50525632

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccc(O)cc1

BDBM50525638

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1cccc(N)c1

BDBM50525618

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1cccc(O)c1

BDBM50525636

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccccc1

BDBM50525628

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccncc1

BDBM50525629

COc1c(cc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O)-c1ccoc1

BDBM50590446

COc1cc(Br)c(cc1S(=O)(=O)Nc1ccccc1C(O)=O)C(C)(C)C

BDBM263071

COc1cc(Cl)cc(NC(=O)N2CC[C@@H]2C(O)=O)c1-c1ccc(F)cc1 |r|

BDBM50152889

COc1ccc(CCc2nc(cc(=O)[nH]2)C(F)(F)F)cc1

BDBM50152879

COc1ccc(CNc2nc(cc(=O)[nH]2)C(F)(F)F)cc1

BDBM50152880

COc1ccc(CSc2nc(cc(=O)[nH]2)C(F)(F)F)cc1

BDBM50536998

COc1ccc(Cl)cc1NCc1cc(=O)n2nc(nc2[nH]1)-c1ccccc1

BDBM50248237

COc1ccc(Cn2c3CCCCc3c3cccc(C(O)=O)c23)cc1

BDBM50468390

COc1ccc(c2ccccc12)S(=O)(=O)NC(C)c1cccc(c1)C(O)=O

BDBM50468366

COc1ccc(c2ccccc12)S(=O)(=O)NCCCCC(O)=O

BDBM50468385

COc1ccc(c2ccccc12)S(=O)(=O)NCc1ccc(cc1)C(O)=O

BDBM50468368

COc1ccc(c2ccccc12)S(=O)(=O)NCc1cccc(c1)C(O)=O

BDBM50468377

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(C(O)=O)c(F)cc1F

BDBM50468386

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(Cl)cc(c1)C(O)=O

BDBM50468373

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(F)cc(c1)C(O)=O

BDBM50468375

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(ccc1C)C(O)=O

BDBM50468374

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(ccc1Cl)C(O)=O

BDBM50468379

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(ccc1F)C(O)=O

BDBM50468376

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(ccn1)C(O)=O

BDBM50468372

COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(C)c(c1)C(O)=O

BDBM50468367

COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(CC(O)=O)cc1

BDBM50468378

COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(C(O)=O)c1F

BDBM50468371

COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM50468389

COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(cc1)C(O)=O

BDBM50468391

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(C(O)=O)c1C

BDBM50468370

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(C(O)=O)c1F

BDBM50468382

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(CC(O)=O)c1

BDBM50468369

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(CCC(O)=O)c1

BDBM50468359

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(c1)C(O)=O

BDBM50468392

COc1ccc(c2ccccc12)S(=O)(=O)Nc1cncc(c1)C(O)=O

BDBM50319706

COc1ccc(cc1)-c1c(NC(=O)CSCC(O)=O)n(C)nc1C(F)(F)F

BDBM263067

COc1ccc(cc1)-c1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1C(O)=O |r|

BDBM50429941

COc1ccc(cc1)-n1nc(cc1-c1ccccc1)-c1ccccc1OCCCC(O)=O

BDBM50468383

COc1ccc(cc1NS(=O)(=O)c1ccc(OC)c2ccccc12)C(O)=O

BDBM50152862

COc1ccc2ccn(c2c1)S(=O)(=O)c1ccccc1C(O)=O

BDBM50152865

COc1ccc2ccn(c2c1)S(=O)(=O)c1ccsc1C(O)=O

BDBM50152854

COc1ccc2n(ccc2c1)S(=O)(=O)c1ccsc1C(O)=O

BDBM50248196

COc1cccc(Cn2c3CCCCc3c3cccc(C(O)=O)c23)c1

BDBM50538230

COc1cccc(Nc2ccccc2C(O)=O)c1-c1ccccc1

BDBM50152866

COc1cccc2ccn(c12)S(=O)(=O)c1ccsc1C(O)=O

BDBM50152855

COc1cccc2n(ccc12)S(=O)(=O)c1ccccc1C(O)=O

BDBM50152874

COc1cccc2n(ccc12)S(=O)(=O)c1ccsc1C(O)=O

BDBM50429952

COc1ccccc1-n1nc(cc1-c1ccccc1)-c1ccccc1OCCCC(O)=O

BDBM50248195

COc1ccccc1Cn1c2CCCCc2c2cccc(C(O)=O)c12

BDBM50177674

COc1cnccc1-c1c(-c2ccccc2)n(CCC(O)=O)c2ccc(cc12)C1CC1 |(6.01,-2.39,;4.83,-2.05,;3.72,-3.12,;4.09,-4.62,;2.98,-5.68,;1.5,-5.26,;1.13,-3.76,;2.24,-2.7,;1.76,-1.24,;2.66,.02,;4.2,.03,;5.05,1.3,;6.59,1.2,;7.27,-.19,;6.41,-1.46,;4.87,-1.36,;1.76,1.24,;2.24,2.7,;3.75,3.01,;4.23,4.48,;3.41,5.4,;5.43,4.73,;.3,.77,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;-3.71,-1.53,;-4.4,-2.82,;-5.17,-1.49,)|

BDBM451179

C[C@@H](CCOc1ccccc1-c1cc(-c2ccccc2Cl)n(n1)-c1ccccc1)C(O)=O |r|

BDBM312362

C[C@@H]1CCc2c(C1)sc(NC(=O)C1=C(CCCC1)C(O)=O)c2-c1nc(no1)C1CC1 |r,t:13|

BDBM451180

C[C@H](CCOc1ccccc1-c1cc(-c2ccccc2Cl)n(n1)-c1ccccc1)C(O)=O |r|

BDBM312363

C[C@H]1CCc2c(C1)sc(NC(=O)C1=C(CCCC1)C(O)=O)c2-c1nc(no1)C1CC1 |r,t:13|

BDBM312475

Cc1[nH]nc(C(=O)Nc2sc3COCCc3c2-c2nc(no2)C2CC2)c1C(O)=O

BDBM312482

Cc1c(C(O)=O)c(nn1C)C(=O)Nc1sc2COCCc2c1-c1nc(no1)C1CC1

BDBM50468358

Cc1c(C)c(C)c(c(C)c1C)S(=O)(=O)NCCCCC(O)=O

BDBM50248192

Cc1c(C)c2cccc(C(O)=O)c2n1Cc1ccccc1

BDBM50536996

Cc1c(Cl)cccc1NCc1cc(=O)n2nc(nc2[nH]1)-c1ccccc1

BDBM50574782

Cc1c(Cl)cccc1OCc1[nH]c2nc(nn2c(=O)c1C)-c1ccccc1

BDBM50525617

Cc1c(Cl)cccc1OCc1cc(=O)n2nc(nc2[nH]1)-c1ccccc1

BDBM234675

Cc1c(sc(NC(=O)C2=C(C3CCC2CC3)C(O)=O)c1-c1nc(no1)C1CC1)C1CC1 |t:8,TLB:16:9:11.12:15.14,THB:6:8:11.12:15.14,(-4.55,.78,;-3.21,.01,;-3.21,-1.53,;-1.75,-2,;-.84,-.76,;.7,-.76,;1.47,-2.09,;.7,-3.43,;3.01,-2.09,;3.78,-3.43,;5.32,-3.43,;6.09,-2.09,;5.32,-.76,;3.78,-.76,;3.78,-2.01,;5.32,-2.01,;3.01,-4.76,;1.47,-4.76,;3.78,-6.09,;-1.75,.49,;-1.35,1.97,;.11,2.45,;.11,3.99,;-1.35,4.47,;-2.26,3.22,;1.45,4.76,;2.99,4.76,;2.22,6.09,;-4.55,-2.3,;-6.09,-2.3,;-5.32,-3.63,)|

BDBM234709

Cc1c(sc(NC(=O)C2=C(C3CCC2CC3)C(O)=O)c1-c1nc(ns1)C1CC1)C1CC1 |t:8,(-4.49,.69,;-3.16,-.08,;-3.16,-1.62,;-1.7,-2.1,;-.79,-.85,;.75,-.85,;1.52,-2.18,;.75,-3.52,;3.06,-2.18,;4.15,-3.27,;5.64,-2.87,;6.03,-1.39,;4.95,-.3,;3.46,-.7,;4.95,-1.09,;4.15,-2.48,;3.75,-4.76,;2.26,-5.16,;4.84,-5.85,;-1.7,.4,;-.93,1.73,;.54,2.21,;.54,3.75,;-.93,4.22,;-1.83,2.98,;1.87,4.52,;3.41,4.52,;2.64,5.85,;-4.49,-2.39,;-6.03,-2.39,;-5.26,-3.72,)|

BDBM234674

Cc1c(sc(NC(=O)C2=C(CCC2)C(O)=O)c1-c1nc(no1)C1CC1)C1CC1 |t:8|

BDBM234685

Cc1c(sc(NC(=O)C2=C(CCC2)C(O)=O)c1-c1nc(no1)C1CC1)C1COC1 |t:8|

BDBM234707

Cc1c(sc(NC(=O)C2=C(CCC2)C(O)=O)c1-c1nc(ns1)C1CC1)C1CC1 |t:8|

BDBM234686

Cc1c(sc(NC(=O)C2=C(CCCC2)C(O)=O)c1-c1nc(no1)C1CC1)C1COC1 |t:8|

BDBM234711

Cc1c(sc(NC(=O)C2=C(CCCC2)C(O)=O)c1-c1nc(ns1)C1CC1)C1CC1 |t:8|

BDBM50152892

Cc1cc(=O)[nH]c(NCc2ccc(Cl)cc2)n1

BDBM50468381

Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCCCCC(O)=O

BDBM50468380

Cc1cc(C)c(c(C)c1)S(=O)(=O)NCCCCC(O)=O

BDBM50187487

Cc1cc(C)c2C3C=CCC3C(N3CC4CC=CC4c1c23)C(O)=O |c:7,17|

BDBM50197087

Cc1cc(Cl)cc2c(-c3ccccc3)c(C(O)=O)c(nc12)N1CCCCC1

BDBM50574780

Cc1cc(F)ccc1-c1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O

BDBM234683

Cc1cc(c(NC(=O)C2=C(CCC2)C(O)=O)s1)-c1nc(no1)C1CC1 |t:8|

BDBM263054

Cc1cc(c(NC(=O)N2CC[C@@H]2C(O)=O)cc1Cl)-c1ccccc1 |r|

BDBM50187489

Cc1cc2C3C=CCC3CN3C(C4CC=CC4c(c1)c23)C(O)=O |c:5,15|

BDBM50152888

Cc1ccc(CNc2nc(cc(=O)[nH]2)C(F)(F)F)cc1

BDBM50247970

Cc1ccc(Cn2c3CCCCc3c3cccc(C(O)=O)c23)cc1

BDBM50319703

Cc1ccc(SC(CC(=O)c2ccc(C)cc2)C(O)=O)cc1

BDBM50429947

Cc1ccc(cc1)-c1cc(nn1-c1ccccc1)-c1ccccc1OCCCC(O)=O

BDBM50429944

Cc1ccc(cc1)-c1cc(nn1-c1ccccc1)-c1ccccc1OCCCCC(O)=O

BDBM50187494

Cc1ccc(cc1C)\N=C1\NC(=O)\C(S1)=C\c1cccn1-c1cccc(c1)C(O)=O

BDBM50152872

Cc1ccc2ccn(c2c1)S(=O)(=O)c1ccsc1C(O)=O

BDBM50152877

Cc1ccc2n(ccc2c1)S(=O)(=O)c1ccccc1C(O)=O

BDBM50152864

Cc1ccc2n(ccc2c1)S(=O)(=O)c1ccsc1C(O)=O

BDBM50538225

Cc1cccc(Nc2ccccc2C(O)=O)c1-c1ccccc1

BDBM50152875

Cc1cccc2n(ccc12)S(=O)(=O)c1ccccc1C(O)=O

BDBM50152876

Cc1cccc2n(ccc12)S(=O)(=O)c1ccsc1C(O)=O

BDBM451177

Cc1ccccc1-c1cc(nn1-c1ccccc1)-c1ccccc1OCCCC(O)=O

BDBM263068

Cc1ccccc1-c1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1C(O)=O |r|

BDBM50152861

Cc1cn(c2ccccc12)S(=O)(=O)c1ccccc1C(O)=O

BDBM50152871

Cc1cn(c2ccccc12)S(=O)(=O)c1ccsc1C(O)=O

BDBM312332

Cc1coc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2COCCc12 |t:12,(1.72,5.35,;.38,4.58,;-1.08,5.06,;-1.99,3.81,;-1.08,2.56,;.38,3.04,;-1.85,1.23,;-.95,-.02,;.59,-.02,;1.36,-1.35,;.59,-2.68,;2.9,-1.35,;3.67,-2.68,;5.21,-2.68,;5.98,-1.35,;5.21,-.02,;3.67,-.02,;4.07,-1.5,;4.82,-1.2,;2.9,-4.02,;1.36,-4.02,;3.67,-5.35,;-1.85,-1.26,;-3.32,-.79,;-4.65,-1.56,;-5.98,-.79,;-5.98,.75,;-4.65,1.52,;-3.32,.75,)|

BDBM312331

Cc1coc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2COCCc12 |t:12|

BDBM234692

Cc1csc(NC(=O)C2=C(CCC2)C(O)=O)c1-c1nc(no1)C1CC1 |t:8|

BDBM312299

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CC(C)(C)CCc12 |t:12,TLB:19:12:14.15:17.18,THB:9:11:14.15:17.18,(2.38,5.35,;1.05,4.58,;-.41,5.06,;-1.32,3.81,;-.41,2.56,;1.05,3.04,;-1.18,1.23,;-.28,-.02,;1.26,-.02,;2.03,-1.35,;1.26,-2.68,;3.57,-1.35,;4.34,-2.68,;5.88,-2.68,;6.65,-1.35,;5.88,-.02,;4.34,-.02,;4.34,-1.16,;5.88,-1.16,;3.57,-4.02,;4.34,-5.35,;2.03,-4.02,;-1.18,-1.26,;-2.65,-.79,;-3.98,-1.56,;-5.32,-.79,;-6.65,-1.56,;-6.65,-.02,;-5.32,.75,;-3.98,1.52,;-2.65,.75,)|

BDBM312439

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CC(CCc12)C(F)(F)F |t:12,(3.05,5.35,;1.72,4.58,;.25,5.06,;-.65,3.81,;.25,2.56,;1.72,3.04,;-.52,1.23,;.39,-.02,;1.93,-.02,;2.7,-1.35,;1.93,-2.68,;4.24,-1.35,;5.01,-2.68,;6.55,-2.68,;7.32,-1.35,;6.55,-.02,;5.01,-.02,;6.01,-1.1,;5.42,-1.68,;4.24,-4.02,;2.7,-4.02,;5.01,-5.35,;-.52,-1.26,;-1.98,-.79,;-3.32,-1.56,;-4.65,-.79,;-4.65,.75,;-3.32,1.52,;-1.98,.75,;-5.98,-1.56,;-7.32,-.79,;-5.98,-3.1,;-7.32,-2.33,)|

BDBM312406

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CC(F)(F)CCc12 |t:12,(2.38,5.35,;1.05,4.58,;-.41,5.06,;-1.32,3.81,;-.41,2.56,;1.05,3.04,;-1.18,1.23,;-.28,-.02,;1.26,-.02,;2.03,-1.35,;1.26,-2.68,;3.57,-1.35,;4.34,-2.68,;5.88,-2.68,;6.65,-1.35,;5.88,-.02,;4.34,-.02,;5.67,-.79,;4.59,-1.87,;3.57,-4.02,;2.03,-4.02,;4.34,-5.35,;-1.18,-1.26,;-2.65,-.79,;-3.98,-1.56,;-5.32,-.79,;-6.65,-1.56,;-6.65,-.02,;-5.32,.75,;-3.98,1.52,;-2.65,.75,)|

BDBM312303

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCCCc12 |t:12,TLB:19:12:14.15:17.18,THB:9:11:14.15:17.18,(2.07,5.35,;.74,4.58,;-.73,5.06,;-1.63,3.81,;-.73,2.56,;.74,3.04,;-1.5,1.23,;-.59,-.02,;.95,-.02,;1.72,-1.35,;.95,-2.68,;3.26,-1.35,;4.03,-2.68,;5.57,-2.68,;6.34,-1.35,;5.57,-.02,;4.03,-.02,;4.03,-1.34,;5.57,-1.34,;3.26,-4.02,;4.03,-5.35,;1.72,-4.02,;-1.5,-1.26,;-2.96,-.79,;-4.17,-1.75,;-5.67,-1.4,;-6.34,-.02,;-5.67,1.37,;-4.17,1.71,;-2.96,.75,)|

BDBM312301

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCCc12 |t:12,(1.72,5.35,;.38,4.58,;-1.08,5.06,;-1.99,3.81,;-1.08,2.56,;.38,3.04,;-1.85,1.23,;-.95,-.02,;.59,-.02,;1.36,-1.35,;.59,-2.68,;2.9,-1.35,;3.67,-2.68,;5.21,-2.68,;5.98,-1.35,;5.21,-.02,;3.67,-.02,;4.07,-1.5,;5.43,-1.5,;2.9,-4.02,;3.67,-5.35,;1.36,-4.02,;-1.85,-1.26,;-3.32,-.79,;-4.65,-1.56,;-5.98,-.79,;-5.98,.75,;-4.65,1.52,;-3.32,.75,)|

BDBM312394

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCc12 |t:12,(2.12,5.01,;.79,4.24,;-.46,5.14,;-1.71,4.24,;-1.23,2.77,;.31,2.77,;-2,1.44,;-1.1,.19,;.44,.19,;1.21,-1.14,;.44,-2.47,;2.75,-1.14,;3.52,-2.47,;5.06,-2.47,;5.83,-1.14,;5.06,.19,;3.52,.19,;4.86,-.58,;3.73,-1.7,;2.75,-3.81,;1.21,-3.81,;3.52,-5.14,;-2,-1.05,;-3.47,-.58,;-4.93,-1.05,;-5.83,.19,;-4.93,1.44,;-3.47,.96,)|

BDBM312308

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2COCCc12 |t:12,TLB:19:12:14.15:18.17,THB:9:11:14.15:18.17,(1.72,5.35,;.38,4.58,;-1.08,5.06,;-1.99,3.81,;-1.08,2.56,;.38,3.04,;-1.85,1.23,;-.95,-.02,;.59,-.02,;1.36,-1.35,;.59,-2.68,;2.9,-1.35,;3.67,-2.68,;5.21,-2.68,;5.98,-1.35,;5.21,-.02,;3.67,-.02,;3.67,-1.32,;5.21,-1.32,;2.9,-4.02,;3.67,-5.35,;1.36,-4.02,;-1.85,-1.26,;-3.32,-.79,;-4.65,-1.56,;-5.98,-.79,;-5.98,.75,;-4.65,1.52,;-3.32,.75,)|

BDBM312441

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2C[C@@H](CCc12)C(F)(F)F |r,wD:25.33,t:12,(3.46,-3.69,;2.13,-4.46,;.67,-3.99,;-.24,-5.23,;.67,-6.48,;2.13,-6,;-.1,-7.81,;.8,-9.06,;2.34,-9.06,;3.11,-10.39,;2.34,-11.72,;4.65,-10.39,;5.42,-11.72,;6.96,-11.72,;7.73,-10.39,;6.96,-9.06,;5.42,-9.06,;6.43,-10.15,;5.83,-10.72,;4.65,-13.06,;3.11,-13.06,;5.42,-14.39,;-.1,-10.3,;-1.57,-9.83,;-2.9,-10.6,;-4.24,-9.83,;-4.24,-8.29,;-2.9,-7.52,;-1.57,-8.29,;-5.57,-10.6,;-6.9,-9.83,;-5.57,-12.14,;-6.9,-11.37,)|

BDBM312440

Cc1csc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2C[C@H](CCc12)C(F)(F)F |r,wU:25.33,t:12,(3.46,-3.69,;2.13,-4.46,;.67,-3.99,;-.24,-5.23,;.67,-6.48,;2.13,-6,;-.1,-7.81,;.8,-9.06,;2.34,-9.06,;3.11,-10.39,;2.34,-11.72,;4.65,-10.39,;5.42,-11.72,;6.96,-11.72,;7.73,-10.39,;6.96,-9.06,;5.42,-9.06,;6.43,-10.15,;5.83,-10.72,;4.65,-13.06,;3.11,-13.06,;5.42,-14.39,;-.1,-10.3,;-1.57,-9.83,;-2.9,-10.6,;-4.24,-9.83,;-4.24,-8.29,;-2.9,-7.52,;-1.57,-8.29,;-5.57,-10.6,;-6.9,-9.83,;-5.57,-12.14,;-6.9,-11.37,)|

BDBM312279

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CC(C)(C)CCc12 |t:12|

BDBM312442

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CC(CCc12)C(F)(F)F |t:12|

BDBM312276

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCC(C)(C)Cc12 |t:12|

BDBM312290

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCCCc12 |t:12|

BDBM312250

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCCc12 |t:12|

BDBM312392

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCc12 |t:12|

BDBM312312

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CN(CCc12)C(=O)OC(C)(C)C |t:12|

BDBM312311

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2COCCc12 |t:12|

BDBM312317

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CS(=O)(=O)CCc12 |t:12|

BDBM312443

Cc1csc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2C[C@@H](CCc12)C(F)(F)F |r,t:12|

BDBM312445

Cc1csc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CC(CCc12)C(F)(F)F |t:12|

BDBM312405

Cc1csc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CC(F)(F)CCc12 |t:12|

BDBM312393

Cc1csc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CCCc12 |t:12|

BDBM312318

Cc1csc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2COCCc12 |t:12|

BDBM312508

Cc1csc(n1)-c1c(NC(=O)C2=C(CCOC2)C(O)=O)sc2CC(F)(F)CCc12 |t:12|

BDBM312507

Cc1csc(n1)-c1c(NC(=O)C2=C(COCC2)C(O)=O)sc2CC(F)(F)CCc12 |t:12|

BDBM312285

Cc1csc(n1)-c1c(NC(=O)C2C3CCC(C=C3)C2C(O)=O)sc2CC(C)(C)CCc12 |c:17,TLB:9:11:16.17:13.14,THB:19:18:16.17:13.14|

BDBM312315

Cc1csc(n1)-c1c(NC(=O)C2CCCN2CC(O)=O)sc2CCCCc12

BDBM312306

Cc1csc(n1)-c1c(NC(=O)N2CCCC[C@@H]2C(O)=O)sc2CCCCCc12 |r|

BDBM312300

Cc1csc(n1)-c1c(NC(=O)[C@@H]2CCCC[C@H]2C(O)=O)sc2CCCCc12 |r|

BDBM312278

Cc1csc(n1)-c1c(NC(=O)[C@H]2CC=CC[C@H]2C(O)=O)sc2CC(C)(C)CCc12 |r,c:14|

BDBM312298

Cc1csc(n1)-c1c(NC(=O)[C@H]2CC=CC[C@H]2C(O)=O)sc2CCCCCc12 |r,c:14|

BDBM312286

Cc1csc(n1)-c1c(NC(=O)[C@H]2CCCC[C@@H]2C(O)=O)sc2CC(C)(C)CCc12 |r|

BDBM312410

Cc1csc(n1)-c1c(NC(=O)[C@H]2CCCC[C@@H]2C(O)=O)sc2CC(F)(F)CCc12 |r|

BDBM312304

Cc1csc(n1)-c1c(NC(=O)[C@H]2CCCC[C@@H]2C(O)=O)sc2CC3(CC3)CCc12 |r|

BDBM312414

Cc1csc(n1)-c1c(NC(=O)[C@H]2CCCC[C@@H]2C(O)=O)sc2CCCCCc12 |r|

BDBM312418

Cc1csc(n1)-c1c(NC(=O)[C@H]2CCCC[C@@H]2C(O)=O)sc2CCCc12 |r|

BDBM312409

Cc1csc(n1)-c1c(NC(=O)[C@H]2CCCC[C@H]2C(O)=O)sc2CC(F)(F)CCc12 |r|

BDBM312413

Cc1csc(n1)-c1c(NC(=O)[C@H]2CCCC[C@H]2C(O)=O)sc2CCCCCc12 |r|

BDBM312417

Cc1csc(n1)-c1c(NC(=O)[C@H]2CCCC[C@H]2C(O)=O)sc2CCCc12 |r|

BDBM312295

Cc1csc(n1)-c1c(NC(=O)c2ccccc2C(O)=O)sc2CC(C)(C)CCc12

BDBM312489

Cc1csc(n1)-c1c(NC(=O)c2ncccc2C(O)=O)sc2CC(F)(F)CCc12

BDBM312488

Cc1csc(n1)-c1c(NC(=O)c2ncccc2C(O)=O)sc2CCCCc12

BDBM312404

Cc1csc(n1)-c1c2CCC(F)(F)Cc2sc1NC(=O)C1=C(CCC1)C(O)=O |t:23|

BDBM312326

Cc1csc(n1)-c1c2CCC3(COC3)Cc2sc1NC(=O)C1=C(CCC1)C(O)=O |t:25|

BDBM312309

Cc1nc(oc1C)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2COCCc12 |t:13|

BDBM312355

Cc1nc(sc1C)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2COCCc12 |t:13|

BDBM50197091

Cc1nc2ccc(Cl)cc2c(-c2ccccc2)c1C(O)=O

BDBM312271

Cc1noc(n1)-c1c(NC(=O)C(F)(F)C(F)(F)C(O)=O)sc2CCCCc12

BDBM234677

Cc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc(C)c1C1CC1 |t:12,TLB:19:12:14.15:18.17,THB:9:11:14.15:18.17,(1.45,5.43,;.11,4.66,;-1.35,5.13,;-2.26,3.89,;-1.35,2.64,;.11,3.12,;-1.75,1.15,;-.84,-.09,;.7,-.09,;1.47,-1.43,;.7,-2.76,;3.01,-1.43,;3.78,-2.76,;5.32,-2.76,;6.09,-1.43,;5.32,-.09,;3.78,-.09,;3.78,-1.34,;5.32,-1.34,;3.01,-4.09,;1.47,-4.09,;3.78,-5.43,;-1.75,-1.34,;-3.21,-.86,;-4.55,-1.63,;-3.21,.68,;-4.55,1.45,;-5.32,2.78,;-6.09,1.45,)|

BDBM312397

Cc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CC(F)(F)CCc12 |t:12,(2.93,5.01,;1.6,4.24,;.36,5.14,;-.89,4.24,;-.41,2.77,;1.13,2.77,;-1.18,1.44,;-.28,.19,;1.26,.19,;2.03,-1.14,;1.26,-2.47,;3.57,-1.14,;4.34,-2.47,;5.88,-2.47,;6.65,-1.14,;5.88,.19,;4.34,.19,;5.67,-.58,;4.55,-1.7,;3.57,-3.81,;2.03,-3.81,;4.34,-5.14,;-1.18,-1.05,;-2.65,-.58,;-3.98,-1.35,;-5.32,-.58,;-6.65,.19,;-6.65,-1.35,;-5.32,.96,;-3.98,1.73,;-2.65,.96,)|

BDBM312325

Cc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CC3(COC3)CCc12 |t:12,(2.66,5.35,;1.33,4.58,;-.14,5.06,;-1.04,3.81,;-.14,2.56,;1.33,3.04,;-.91,1.23,;-0,-.02,;1.54,-.02,;2.31,-1.35,;1.54,-2.68,;3.85,-1.35,;4.62,-2.68,;6.16,-2.68,;6.93,-1.35,;6.16,-.02,;4.62,-.02,;4.92,-1.49,;5.72,-1.27,;3.85,-4.02,;2.31,-4.02,;4.62,-5.35,;-.91,-1.26,;-2.37,-.79,;-3.71,-1.56,;-5.04,-.79,;-6.53,-.39,;-6.93,-1.87,;-5.44,-2.27,;-5.04,.75,;-3.71,1.52,;-2.37,.75,)|

BDBM312349

Cc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCC(C)(C)c12 |t:12,(1.57,5.35,;.23,4.58,;-1.23,5.06,;-2.14,3.81,;-1.23,2.56,;.23,3.04,;-2,1.23,;-1.1,-.02,;.44,-.02,;1.21,-1.35,;.44,-2.68,;2.75,-1.35,;3.52,-2.68,;5.06,-2.68,;5.83,-1.35,;5.06,-.02,;3.52,-.02,;3.92,-1.5,;4.67,-1.2,;2.75,-4.02,;1.21,-4.02,;3.52,-5.35,;-2,-1.26,;-3.46,-.79,;-4.93,-1.26,;-5.83,-.02,;-4.93,1.23,;-5.7,2.56,;-4.16,2.56,;-3.46,.75,)|

BDBM312376

Cc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCCCc12 |t:12,(2.07,5.35,;.74,4.58,;-.73,5.06,;-1.63,3.81,;-.73,2.56,;.74,3.04,;-1.5,1.23,;-.59,-.02,;.95,-.02,;1.72,-1.35,;.95,-2.68,;3.26,-1.35,;4.03,-2.68,;5.57,-2.68,;6.34,-1.35,;5.57,-.02,;4.03,-.02,;5.36,-.79,;4.23,-1.91,;3.26,-4.02,;1.72,-4.02,;4.03,-5.35,;-1.5,-1.26,;-2.96,-.79,;-4.17,-1.75,;-5.67,-1.4,;-6.34,-.02,;-5.67,1.37,;-4.17,1.71,;-2.96,.75,)|

BDBM312254

Cc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCCc12 |t:12,TLB:19:12:14.15:17.18,THB:9:11:14.15:17.18,(1.35,5.43,;.01,4.66,;-1.45,5.13,;-2.36,3.89,;-1.45,2.64,;.01,3.12,;-1.85,1.15,;-.95,-.09,;.59,-.09,;1.36,-1.43,;.59,-2.76,;2.9,-1.43,;3.67,-2.76,;5.21,-2.76,;5.98,-1.43,;5.21,-.09,;3.67,-.09,;3.67,-1.63,;5.16,-1.23,;2.9,-4.09,;1.36,-4.09,;3.67,-5.43,;-1.85,-1.34,;-3.32,-.86,;-4.65,-1.63,;-5.98,-.86,;-5.98,.68,;-4.65,1.45,;-3.32,.68,)|

BDBM312385

Cc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCc12 |t:12,(2.12,5.01,;.79,4.24,;-.46,5.14,;-1.71,4.24,;-1.23,2.77,;.31,2.77,;-2,1.44,;-1.1,.19,;.44,.19,;1.21,-1.14,;.44,-2.47,;2.75,-1.14,;3.52,-2.47,;5.06,-2.47,;5.83,-1.14,;5.06,.19,;3.52,.19,;4.86,-.58,;3.73,-1.7,;2.75,-3.81,;1.21,-3.81,;3.52,-5.14,;-2,-1.05,;-3.47,-.58,;-4.93,-1.05,;-5.83,.19,;-4.93,1.44,;-3.47,.96,)|

BDBM312358

Cc1noc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2COCCc12 |t:12,(1.72,5.35,;.38,4.58,;-1.08,5.06,;-1.99,3.81,;-1.08,2.56,;.38,3.04,;-1.85,1.23,;-.95,-.02,;.59,-.02,;1.36,-1.35,;.59,-2.68,;2.9,-1.35,;3.67,-2.68,;5.21,-2.68,;5.98,-1.35,;5.21,-.02,;3.67,-.02,;4.07,-1.5,;4.82,-1.2,;2.9,-4.02,;1.36,-4.02,;3.67,-5.35,;-1.85,-1.26,;-3.32,-.79,;-4.65,-1.56,;-5.98,-.79,;-5.98,.75,;-4.65,1.52,;-3.32,.75,)|

BDBM234671

Cc1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc(C)c1C1CC1 |t:12|

BDBM312330

Cc1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCC(C)(C)c12 |t:12|

BDBM312374

Cc1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCCCc12 |t:12|

BDBM312241

Cc1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCCc12 |t:12|

BDBM312383

Cc1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCc12 |t:12|

BDBM312359

Cc1noc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2COCCc12 |t:12|

BDBM234676

Cc1noc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc(C)c1C1CC1 |t:12|

BDBM312396

Cc1noc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CC(F)(F)CCc12 |t:12|

BDBM312348

Cc1noc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CCC(C)(C)c12 |t:12|

BDBM312375

Cc1noc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CCCCCc12 |t:12|

BDBM312242

Cc1noc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CCCCc12 |t:12|

BDBM312384

Cc1noc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CCCc12 |t:12|

BDBM312354

Cc1noc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2COCCc12 |t:12|

BDBM312291

Cc1noc(n1)-c1c(NC(=O)C2C3CCC(C=C3)C2C(O)=O)sc2CCCCc12 |c:17|

BDBM312335

Cc1noc(n1)-c1c(NC(=O)CC(C)(C)C(O)=O)sc2CCCCc12

BDBM312353

Cc1noc(n1)-c1c(NC(=O)CC(C)(C)CC(O)=O)sc2CCCCc12

BDBM312509

Cc1noc(n1)-c1c(NC(=O)N2CCC[C@@H]2C(O)=O)sc2CCCCCc12 |r|

BDBM312272

Cc1noc(n1)-c1c(NC(=O)N2CCC[C@@H]2C(O)=O)sc2CCCCc12 |r|

BDBM312253

Cc1noc(n1)-c1c(NC(=O)[C@@H]2[C@H](C(O)=O)C2(C)C)sc2CCCCc12 |r|

BDBM312267

Cc1noc(n1)-c1c(NC(=O)[C@H]2CC=CC[C@H]2C(O)=O)sc2CCCCc12 |r,c:14|

BDBM312287

Cc1noc(n1)-c1c(NC(=O)[C@H]2CCCC[C@@H]2C(O)=O)sc2CCCCc12 |r|

BDBM312255

Cc1noc(n1)-c1c(NC(=O)[C@H]2CCCC[C@H]2C(O)=O)sc2CCCCc12 |r|

BDBM312249

Cc1noc(n1)-c1c(NC(=O)[C@H]2CCC[C@H]2C(O)=O)sc2CCCCc12 |r|

BDBM312246

Cc1noc(n1)-c1c(NC(=O)\C=C/C(O)=O)sc2CCCCc12

BDBM312288

Cc1noc(n1)-c1c(NC(=O)c2ccccc2C(O)=O)sc2CCCCc12

BDBM312252

Cc1noc(n1)-c1c(NC(=O)c2nccnc2C(O)=O)sc2CCCCc12

BDBM312395

Cc1noc(n1)-c1c2CCC(F)(F)Cc2sc1NC(=O)C1=C(CCC1)C(O)=O |t:23|

BDBM312324

Cc1noc(n1)-c1c2CCC3(COC3)Cc2sc1NC(=O)C1=C(CCC1)C(O)=O |t:25|

BDBM312367

Cc1noc(n1)-c1c2CCCCc2sc1NC(=O)[C@]12C[C@]1(CCC2)C(O)=O |r|

BDBM234700

Cc1nsc(n1)-c1c(C)c(C)sc1NC(=O)C1=C(C2CCC1CC2)C(O)=O |t:18,(1.1,5.18,;-.23,4.41,;-1.7,4.89,;-2.6,3.64,;-1.7,2.4,;-.23,2.87,;-2.47,1.06,;-3.93,.59,;-5.26,1.36,;-3.93,-.95,;-5.26,-1.72,;-2.47,-1.43,;-1.56,-.18,;-.02,-.18,;.75,-1.52,;-.02,-2.85,;2.29,-1.52,;3.38,-2.61,;4.87,-2.21,;5.26,-.72,;4.18,.37,;2.69,-.03,;4.18,-.43,;3.38,-1.81,;2.98,-4.09,;1.49,-4.49,;4.07,-5.18,)|

BDBM234708

Cc1nsc(n1)-c1c(C)c(C)sc1NC(=O)C1=C(CCC1)C(O)=O |t:18|

BDBM234710

Cc1nsc(n1)-c1c(C)c(C)sc1NC(=O)C1=C(CCCC1)C(O)=O |t:18|

BDBM234706

Cc1nsc(n1)-c1c(C)c(sc1NC(=O)C1=C(C2CCC1CC2)C(O)=O)C1CC1 |t:17,(1.87,5.18,;.54,4.41,;-.93,4.89,;-1.83,3.64,;-.93,2.4,;.54,2.87,;-1.7,1.06,;-3.16,.59,;-4.49,1.36,;-3.16,-.95,;-1.7,-1.43,;-.79,-.18,;.75,-.18,;1.52,-1.52,;.75,-2.85,;3.06,-1.52,;4.15,-2.61,;5.64,-2.21,;6.03,-.72,;4.95,.37,;3.46,-.03,;4.95,-.43,;4.15,-1.81,;3.75,-4.09,;2.26,-4.49,;4.84,-5.18,;-4.49,-1.72,;-6.03,-1.72,;-5.26,-3.06,)|

BDBM234704

Cc1nsc(n1)-c1c(C)c(sc1NC(=O)C1=C(CCC1)C(O)=O)C1CC1 |t:17|

BDBM234705

Cc1nsc(n1)-c1c(C)c(sc1NC(=O)C1=C(CCCC1)C(O)=O)C1CC1 |t:17|

BDBM312459

Cc1nsc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CC(F)(F)CCc12 |t:12,(2.44,5.18,;1.1,4.41,;-.36,4.89,;-1.27,3.64,;-.36,2.4,;1.1,2.87,;-1.13,1.06,;-.23,-.18,;1.31,-.18,;2.08,-1.52,;1.31,-2.85,;3.62,-1.52,;4.71,-2.61,;6.2,-2.21,;6.6,-.72,;5.51,.37,;4.02,-.03,;5.51,-.43,;4.74,-1.76,;4.31,-4.09,;2.83,-4.49,;5.4,-5.18,;-1.13,-1.43,;-2.6,-.95,;-3.93,-1.72,;-5.26,-.95,;-6.6,-1.72,;-6.6,-.18,;-5.26,.59,;-3.93,1.36,;-2.6,.59,)|

BDBM312458

Cc1nsc(n1)-c1c(NC(=O)C2=C(C3CCC2CC3)C(O)=O)sc2CCCCc12 |t:12,(1.77,5.18,;.44,4.41,;-1.03,4.89,;-1.93,3.64,;-1.03,2.4,;.44,2.87,;-1.8,1.06,;-.89,-.18,;.65,-.18,;1.42,-1.52,;.65,-2.85,;2.96,-1.52,;4.05,-2.61,;5.53,-2.21,;5.93,-.72,;4.84,.37,;3.35,-.03,;4.84,-.43,;4.07,-1.76,;3.65,-4.09,;2.16,-4.49,;4.74,-5.18,;-1.8,-1.43,;-3.26,-.95,;-4.6,-1.72,;-5.93,-.95,;-5.93,.59,;-4.6,1.36,;-3.26,.59,)|

BDBM312450

Cc1nsc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CC(F)(F)CCc12 |t:12|

BDBM312455

Cc1nsc(n1)-c1c(NC(=O)C2=C(CCC2)C(O)=O)sc2CCCCc12 |t:12|

BDBM312451

Cc1nsc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CC(F)(F)CCc12 |t:12|

BDBM312456

Cc1nsc(n1)-c1c(NC(=O)C2=C(CCCC2)C(O)=O)sc2CCCCc12 |t:12|

BDBM234672

Cc1sc(NC(=O)C2=C(C3CCC2CC3)C(O)=O)c(-c2nc(no2)C(F)(F)F)c1C1CC1 |t:7,TLB:15:8:10.11:14.13,THB:5:7:10.11:14.13,(-4.55,-2.4,;-3.21,-1.63,;-1.75,-2.11,;-.84,-.86,;.7,-.86,;1.47,-2.2,;.7,-3.53,;3.01,-2.2,;3.78,-3.53,;5.32,-3.53,;6.09,-2.2,;5.32,-.86,;3.78,-.86,;3.78,-2.11,;5.32,-2.11,;3.01,-4.86,;1.47,-4.86,;3.78,-6.2,;-1.75,.38,;-1.35,1.87,;.11,2.35,;.11,3.89,;-1.35,4.36,;-2.26,3.12,;1.45,4.66,;2.78,3.89,;1.45,6.2,;2.78,5.43,;-3.21,-.09,;-4.55,.68,;-5.32,2.01,;-6.09,.68,)|

BDBM234679

Cc1sc(NC(=O)C2=C(C3CCC2CC3)C(O)=O)c(-c2nc(no2)C2CC2)c1C1CC1 |t:7,TLB:15:8:10.11:14.13,THB:5:7:10.11:14.13,(-4.55,-2.3,;-3.21,-1.53,;-1.75,-2,;-.84,-.76,;.7,-.76,;1.47,-2.09,;.7,-3.43,;3.01,-2.09,;3.78,-3.43,;5.32,-3.43,;6.09,-2.09,;5.32,-.76,;3.78,-.76,;3.78,-2.01,;5.32,-2.01,;3.01,-4.76,;1.47,-4.76,;3.78,-6.09,;-1.75,.49,;-1.35,1.97,;.11,2.45,;.11,3.99,;-1.35,4.47,;-2.26,3.22,;1.45,4.76,;2.99,4.76,;2.22,6.09,;-3.21,.01,;-4.55,.78,;-5.32,2.11,;-6.09,.78,)|

BDBM234680

Cc1sc(NC(=O)C2=C(C3CCC2CC3)C(O)=O)c(c1C)-c1nc(no1)C1CC1 |t:7,TLB:15:8:10.11:14.13,THB:5:7:10.11:14.13,(-5.32,-2.3,;-3.98,-1.53,;-2.52,-2,;-1.61,-.76,;-.07,-.76,;.7,-2.09,;-.07,-3.43,;2.24,-2.09,;3.01,-3.43,;4.55,-3.43,;5.32,-2.09,;4.55,-.76,;3.01,-.76,;3.01,-2.01,;4.55,-2.01,;2.24,-4.76,;.7,-4.76,;3.01,-6.09,;-2.52,.49,;-3.98,.01,;-5.32,.78,;-2.12,1.97,;-.66,2.45,;-.66,3.99,;-2.12,4.47,;-3.03,3.22,;.68,4.76,;2.22,4.76,;1.45,6.09,)|

BDBM234703

Cc1sc(NC(=O)C2=C(C3CCC2CC3)C(O)=O)c(c1C)-c1nc(ns1)C1CC1 |t:7,TLB:5:7:10.11:13.14,THB:15:8:10.11:13.14,(-5.26,-2.39,;-3.93,-1.62,;-2.47,-2.1,;-1.56,-.85,;-.02,-.85,;.75,-2.18,;-.02,-3.52,;2.29,-2.18,;3.38,-3.27,;4.87,-2.87,;5.26,-1.39,;4.18,-.3,;2.69,-.7,;3.46,-2.03,;4.87,-1.33,;2.98,-4.76,;1.49,-5.16,;4.07,-5.85,;-2.47,.4,;-3.93,-.08,;-5.26,.69,;-1.7,1.73,;-.23,2.21,;-.23,3.75,;-1.7,4.22,;-2.6,2.98,;1.1,4.52,;2.64,4.52,;1.87,5.85,)|

BDBM234682

Cc1sc(NC(=O)C2=C(CCC2)C(O)=O)c(-c2nc(no2)C(F)(F)F)c1C1CC1 |t:7|

BDBM234687

Cc1sc(NC(=O)C2=C(CCC2)C(O)=O)c(-c2nc(no2)C2CC2)c1C(F)(F)F |t:7|

BDBM234678

Cc1sc(NC(=O)C2=C(CCC2)C(O)=O)c(-c2nc(no2)C2CC2)c1C1CC1 |t:7|

BDBM234681

Cc1sc(NC(=O)C2=C(CCC2)C(O)=O)c(c1C)-c1nc(no1)C1CC1 |t:7|

BDBM234701

Cc1sc(NC(=O)C2=C(CCC2)C(O)=O)c(c1C)-c1nc(ns1)C1CC1 |t:7|

BDBM234673

Cc1sc(NC(=O)C2=C(CCCC2)C(O)=O)c(c1C)-c1nc(no1)C1CC1 |t:7|

BDBM234702

Cc1sc(NC(=O)C2=C(CCCC2)C(O)=O)c(c1C)-c1nc(ns1)C1CC1 |t:7|

BDBM234698

Cc1sc(NC(=O)C2=C(COCC2)C(O)=O)c(c1C)-c1nc(no1)C1CC1 |t:7|

BDBM234696

Cc1sc(NC(=O)C2CCCCC2C(O)=O)c(c1C)-c1nc(no1)C1CC1

BDBM234699

Cc1sc(NC(=O)N2CCC[C@@H]2C(O)=O)c(c1C)-c1nc(no1)C(F)(F)F |r|

BDBM50152893

Clc1ccc(CNc2nc(cc(=O)[nH]2)-c2ccccc2)cc1

BDBM50319705

Clc1ccc(c(Cl)c1)S(=O)(=O)CCSc1n[nH]c(=O)n1-c1ccc2OCCOc2c1

BDBM50197089

Clc1ccc2nc(N3CCCCC3)c(-c3n[nH]c(=O)o3)c(-c3ccccc3)c2c1

BDBM50197090

Clc1ccc2nc(N3CCCCC3)c(-c3n[nH]c(=S)o3)c(-c3ccccc3)c2c1

BDBM50197093

Clc1ccc2nc(N3CCCCC3)c(-c3nnn[nH]3)c(-c3ccccc3)c2c1

BDBM50536999

Clc1cccc(NCc2cc(=O)n3nc(nc3[nH]2)-c2ccccc2)c1C1CC1

BDBM50212885

Cn1c(nc(c1-c1ccccc1)-c1ccccc1)-c1ccccc1-c1cccc(NCC(O)=O)c1

BDBM50212881

Cn1c(nc(c1-c1ccccc1)-c1ccccc1)-c1ccccc1-c1cccc(OCC(O)=O)c1

BDBM312297

Cn1ncc(C(=O)Nc2sc3CCCCc3c2-c2nc(no2)C2CC2)c1C(O)=O

BDBM50152894

FC(F)(F)c1cc(=O)[nH]c(CCc2ccccc2)n1

BDBM50152890

FC(F)(F)c1cc(=O)[nH]c(NCC(=O)N2CCCCC2)n1

BDBM50152898

FC(F)(F)c1cc(=O)[nH]c(NCCc2ccccc2)n1

BDBM50152891

FC(F)(F)c1cc(=O)[nH]c(NCc2ccc(Cl)cc2)n1

BDBM50152884

FC(F)(F)c1cc(=O)[nH]c(NCc2ccc(cc2)-c2ccccc2)n1

BDBM50152881

FC(F)(F)c1cc(=O)[nH]c(NCc2cccc(Cl)c2)n1

BDBM50152885

FC(F)(F)c1cc(=O)[nH]c(NCc2ccccc2)n1

BDBM50152887

FC(F)(F)c1cc(=O)[nH]c(NCc2ccccc2Cl)n1

BDBM50152895

FC(F)(F)c1cc(=O)[nH]c(NCc2ccncc2)n1

BDBM50152896

FC(F)(F)c1cc(=O)[nH]c(Nc2ccccc2)n1

BDBM50152883

FC(F)(F)c1cc(=O)[nH]c(SCC(=O)N2CCCCC2)n1

BDBM50152882

Fc1ccccc1-c1cc(=O)[nH]c(NCc2ccc(Cl)cc2)n1

BDBM50248245

NC(=O)c1cccc(Cn2c3CCCCCc3c3cccc(C(O)=O)c23)c1

BDBM263063

NC(=O)c1cccc(c1)-c1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1C(O)=O |r|

BDBM50248244

NC(=O)c1ccccc1Cn1c2CCCCCc2c2cccc(C(O)=O)c12

BDBM50152868

NC(=O)c1cn(c2ccccc12)S(=O)(=O)c1ccccc1C(O)=O

BDBM50152873

NC(=O)c1cn(c2ccccc12)S(=O)(=O)c1ccsc1C(O)=O

BDBM212452

OC(=O)C1(CC1)NC(=O)Nc1cc(Cl)c(F)cc1-c1ccccc1

BDBM212455

OC(=O)C1(CC1)NC(=O)Nc1cc(Cl)cc(Cl)c1-c1ccccc1

BDBM212450

OC(=O)C1(CC1)NC(=O)Nc1cc(Cl)ccc1-c1ccc(F)cc1

BDBM212448

OC(=O)C1(CC1)NC(=O)Nc1cc(Cl)ccc1-c1ccccc1

BDBM212458

OC(=O)C1(CC1)NC(=O)Nc1cc(ccc1-c1ccccc1)C(F)(F)F

BDBM212460

OC(=O)C1(CC1)NC(=O)Nc1ccc(Cl)cc1-c1ccc(F)cc1

BDBM212453

OC(=O)C1(CC1)NC(=O)Nc1ccc(Cl)cc1-c1ccccc1

BDBM212449

OC(=O)C1(CCC1)NC(=O)Nc1cc(Cl)ccc1-c1ccccc1

BDBM212454

OC(=O)C1(CCCC1)NC(=O)Nc1cc(Cl)c(F)cc1-c1ccccc1

BDBM212456

OC(=O)C1(CCCC1)NC(=O)Nc1cc(Cl)cc(Cl)c1-c1ccccc1

BDBM212451

OC(=O)C1(CCCC1)NC(=O)Nc1cc(Cl)ccc1-c1ccc(F)cc1

BDBM212447

OC(=O)C1(CCCC1)NC(=O)Nc1cc(Cl)ccc1-c1ccccc1

BDBM212457

OC(=O)C1(CCCC1)NC(=O)Nc1cc(ccc1-c1ccccc1)C(F)(F)F

BDBM212459

OC(=O)C1(CCCC1)NC(=O)Nc1ccc(Cl)cc1-c1ccc(F)cc1

BDBM212461

OC(=O)C1(CCCC1)NC(=O)Nc1ccc(Cl)cc1-c1ccccc1

BDBM263029

OC(=O)C1(CCCN1C(=O)Nc1ccccc1-c1ccccc1)c1ccccc1

BDBM312430

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CC(CCc2c1-c1nc(no1)C1CC1)C(F)(F)F |t:3,(2.7,-4.76,;4.24,-4.76,;5.01,-6.09,;5.01,-3.43,;4.24,-2.09,;5.01,-.76,;6.55,-.76,;7.32,-2.09,;6.55,-3.43,;5.42,-2.43,;6.01,-1.85,;2.7,-2.09,;1.93,-3.43,;1.93,-.76,;.39,-.76,;-.52,-2,;-1.98,-1.53,;-3.32,-2.3,;-4.65,-1.53,;-4.65,.01,;-3.32,.78,;-1.98,.01,;-.52,.49,;.25,1.82,;1.72,2.3,;1.72,3.84,;.25,4.31,;-.65,3.07,;3.05,4.61,;4.54,5,;3.45,6.09,;-5.98,-2.3,;-7.32,-1.53,;-5.98,-3.84,;-7.32,-3.07,)|

BDBM312400

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C1CC1 |t:3,(2.03,-4.41,;3.57,-4.41,;4.34,-5.74,;4.34,-3.07,;3.57,-1.74,;4.34,-.41,;5.88,-.41,;6.65,-1.74,;5.88,-3.07,;4.59,-2.27,;5.67,-1.18,;2.03,-1.74,;1.26,-3.07,;1.26,-.41,;-.28,-.41,;-1.18,-1.65,;-2.65,-1.18,;-3.98,-1.95,;-5.32,-1.18,;-6.65,-1.95,;-6.65,-.41,;-5.32,.36,;-3.98,1.13,;-2.65,.36,;-1.18,.84,;-.41,2.17,;1.13,2.17,;1.6,3.64,;.36,4.54,;-.89,3.64,;2.93,4.41,;4.47,4.41,;3.7,5.74,)|

BDBM312466

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(ns1)C1CC1 |t:3,(2.45,-5.59,;3.94,-5.2,;5.03,-6.28,;4.34,-3.71,;3.57,-2.37,;4.34,-1.04,;5.88,-1.04,;6.65,-2.37,;5.88,-3.71,;4.55,-2.94,;5.64,-1.85,;2.03,-2.37,;1.26,-3.71,;1.26,-1.04,;-.28,-1.04,;-1.18,-2.29,;-2.65,-1.81,;-3.98,-2.58,;-5.32,-1.81,;-6.65,-1.04,;-6.09,-3.14,;-5.32,-.27,;-3.98,.5,;-2.65,-.27,;-1.18,.2,;-.79,1.69,;.68,2.17,;.68,3.71,;-.79,4.18,;-1.69,2.94,;1.77,4.8,;3.25,5.2,;2.17,6.28,)|

BDBM312382

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C(F)(F)F |t:3,(1.72,-4.41,;3.26,-4.41,;4.03,-5.74,;4.03,-3.07,;3.26,-1.74,;4.03,-.41,;5.57,-.41,;6.34,-1.74,;5.57,-3.07,;4.23,-2.3,;5.36,-1.18,;1.72,-1.74,;.95,-3.07,;.95,-.41,;-.59,-.41,;-1.5,-1.65,;-2.96,-1.18,;-4.17,-2.14,;-5.67,-1.79,;-6.34,-.41,;-5.67,.98,;-4.17,1.32,;-2.96,.36,;-1.5,.84,;-.73,2.17,;.81,2.17,;1.29,3.64,;.04,4.54,;-1.2,3.64,;2.62,4.41,;3.95,3.64,;3.39,5.74,;1.85,5.74,)|

BDBM312379

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C1CC1 |t:3,(1.72,-4.41,;3.26,-4.41,;4.03,-5.74,;4.03,-3.07,;3.26,-1.74,;4.03,-.41,;5.57,-.41,;6.34,-1.74,;5.57,-3.07,;4.23,-2.3,;5.36,-1.18,;1.72,-1.74,;.95,-3.07,;.95,-.41,;-.59,-.41,;-1.5,-1.65,;-2.96,-1.18,;-4.17,-2.14,;-5.67,-1.79,;-6.34,-.41,;-5.67,.98,;-4.17,1.32,;-2.96,.36,;-1.5,.84,;-.73,2.17,;.81,2.17,;1.29,3.64,;.04,4.54,;-1.2,3.64,;2.62,4.41,;4.16,4.41,;3.39,5.74,)|

BDBM312341

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCCc2c1-c1nc(cs1)C(F)(F)F |t:3,(1.36,-4.68,;2.9,-4.68,;3.67,-6.02,;3.67,-3.35,;2.9,-2.02,;3.67,-.68,;5.21,-.68,;5.98,-2.02,;5.21,-3.35,;4.82,-1.86,;4.07,-2.17,;1.36,-2.02,;.59,-3.35,;.59,-.68,;-.95,-.68,;-1.85,-1.93,;-3.32,-1.45,;-4.65,-2.22,;-5.98,-1.45,;-5.98,.09,;-4.65,.86,;-3.32,.09,;-1.85,.56,;-1.08,1.9,;.38,2.37,;.38,3.91,;-1.08,4.39,;-1.99,3.14,;1.72,4.68,;3.05,3.91,;.95,6.02,;2.49,6.02,)|

BDBM312314

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C(F)(F)F |t:3,(1.36,-4.68,;2.9,-4.68,;3.67,-6.02,;3.67,-3.35,;2.9,-2.02,;3.67,-.68,;5.21,-.68,;5.98,-2.02,;5.21,-3.35,;4.86,-1.94,;4.07,-2.17,;1.36,-2.02,;.59,-3.35,;.59,-.68,;-.95,-.68,;-1.85,-1.93,;-3.32,-1.45,;-4.65,-2.22,;-5.98,-1.45,;-5.98,.09,;-4.65,.86,;-3.32,.09,;-1.85,.56,;-1.08,1.9,;.38,2.37,;.38,3.91,;-1.08,4.39,;-1.99,3.14,;1.72,4.68,;3.05,3.91,;.95,6.02,;2.49,6.02,)|

BDBM312283

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |t:3,(3.67,-6.25,;2.9,-4.92,;1.42,-5.32,;3.67,-3.59,;2.9,-2.25,;3.67,-.92,;5.21,-.92,;5.98,-2.25,;5.21,-3.59,;4.96,-2.1,;3.9,-2.43,;1.36,-2.25,;.59,-3.59,;.59,-.92,;-.95,-.92,;-1.85,-2.16,;-3.32,-1.69,;-4.65,-2.46,;-5.98,-1.69,;-5.98,-.15,;-4.65,.62,;-3.32,-.15,;-1.85,.33,;-1.08,1.66,;.38,2.14,;.38,3.68,;-1.08,4.15,;-1.99,2.91,;1.47,4.77,;2.96,5.16,;1.87,6.25,)|

BDBM312465

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCCc2c1-c1nc(ns1)C1CC1 |t:3,(1.79,-5.59,;3.28,-5.2,;4.36,-6.28,;3.67,-3.71,;2.9,-2.37,;3.67,-1.04,;5.21,-1.04,;5.98,-2.37,;5.21,-3.71,;3.88,-2.94,;4.97,-1.85,;1.36,-2.37,;.59,-3.71,;.59,-1.04,;-.95,-1.04,;-1.85,-2.29,;-3.32,-1.81,;-4.65,-2.58,;-5.98,-1.81,;-5.98,-.27,;-4.65,.5,;-3.32,-.27,;-1.85,.2,;-1.45,1.69,;.01,2.17,;.01,3.71,;-1.45,4.18,;-2.36,2.94,;1.1,4.8,;2.59,5.2,;1.5,6.28,)|

BDBM312268

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCCc2c1-c1ncccn1 |t:3,(1.36,-4.19,;2.9,-4.19,;3.67,-5.52,;3.67,-2.85,;2.9,-1.52,;3.67,-.19,;5.21,-.19,;5.98,-1.52,;5.21,-2.85,;4.82,-1.37,;4.07,-1.67,;1.36,-1.52,;.59,-2.85,;.59,-.19,;-.95,-.19,;-1.85,-1.43,;-3.32,-.96,;-4.65,-1.73,;-5.98,-.96,;-5.98,.58,;-4.65,1.35,;-3.32,.58,;-1.85,1.06,;-1.45,2.55,;.03,2.95,;.43,4.43,;-.66,5.52,;-2.14,5.12,;-2.54,3.64,)|

BDBM312270

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCCc2c1-c1ncon1 |t:3,(1.36,-3.87,;2.9,-3.87,;3.67,-5.2,;3.67,-2.54,;2.9,-1.2,;3.67,.13,;5.21,.13,;5.98,-1.2,;5.21,-2.54,;4.82,-1.05,;4.07,-1.36,;1.36,-1.2,;.59,-2.54,;.59,.13,;-.95,.13,;-1.85,-1.11,;-3.32,-.64,;-4.65,-1.41,;-5.98,-.64,;-5.98,.9,;-4.65,1.67,;-3.32,.9,;-1.85,1.38,;-1.08,2.71,;-1.99,3.96,;-1.08,5.2,;.38,4.73,;.38,3.19,)|

BDBM312391

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCc2c1-c1nc(no1)C(F)(F)F |t:3,(1.21,-4.68,;2.75,-4.68,;3.52,-6.02,;3.52,-3.35,;2.75,-2.02,;3.52,-.68,;5.06,-.68,;5.83,-2.02,;5.06,-3.35,;3.73,-2.58,;4.86,-1.45,;1.21,-2.02,;.44,-3.35,;.44,-.68,;-1.1,-.68,;-2,-1.93,;-3.47,-1.45,;-4.93,-1.93,;-5.83,-.68,;-4.93,.56,;-3.47,.09,;-2,.56,;-1.23,1.9,;.23,2.37,;.23,3.91,;-1.23,4.39,;-2.14,3.14,;1.57,4.68,;2.9,3.91,;.8,6.02,;2.34,6.02,)|

BDBM312388

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2CCCc2c1-c1nc(no1)C1CC1 |t:3,(1.21,-4.41,;2.75,-4.41,;3.52,-5.74,;3.52,-3.07,;2.75,-1.74,;3.52,-.41,;5.06,-.41,;5.83,-1.74,;5.06,-3.07,;3.73,-2.3,;4.86,-1.18,;1.21,-1.74,;.44,-3.07,;.44,-.41,;-1.1,-.41,;-2,-1.65,;-3.47,-1.18,;-4.93,-1.65,;-5.83,-.41,;-4.93,.84,;-3.47,.36,;-2,.84,;-1.23,2.17,;.31,2.17,;.79,3.64,;-.46,4.54,;-1.71,3.64,;2.12,4.41,;3.66,4.41,;2.89,5.74,)|

BDBM312345

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2COCCc2c1-c1nc(cs1)C(F)(F)F |t:3,(1.36,-4.68,;2.9,-4.68,;3.67,-6.02,;3.67,-3.35,;2.9,-2.02,;3.67,-.68,;5.21,-.68,;5.98,-2.02,;5.21,-3.35,;3.88,-2.58,;5.01,-1.45,;1.36,-2.02,;.59,-3.35,;.59,-.68,;-.95,-.68,;-1.85,-1.93,;-3.32,-1.45,;-4.65,-2.22,;-5.98,-1.45,;-5.98,.09,;-4.65,.86,;-3.32,.09,;-1.85,.56,;-1.08,1.9,;.38,2.37,;.38,3.91,;-1.08,4.39,;-1.99,3.14,;1.72,4.68,;3.05,3.91,;.95,6.02,;2.49,6.02,)|

BDBM312351

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2COCCc2c1-c1nc(cs1)C1CC1 |t:3,(1.36,-4.68,;2.9,-4.68,;3.67,-6.02,;3.67,-3.35,;2.9,-2.02,;3.67,-.68,;5.21,-.68,;5.98,-2.02,;5.21,-3.35,;3.88,-2.58,;5.01,-1.45,;1.36,-2.02,;.59,-3.35,;.59,-.68,;-.95,-.68,;-1.85,-1.93,;-3.32,-1.45,;-4.65,-2.22,;-5.98,-1.45,;-5.98,.09,;-4.65,.86,;-3.32,.09,;-1.85,.56,;-1.08,1.9,;.38,2.37,;.38,3.91,;-1.08,4.39,;-1.99,3.14,;1.72,4.68,;3.26,4.68,;2.49,6.02,)|

BDBM312316

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2COCCc2c1-c1nc(no1)C1CC1 |t:3,(1.36,-4.68,;2.9,-4.68,;3.67,-6.02,;3.67,-3.35,;2.9,-2.02,;3.67,-.68,;5.21,-.68,;5.98,-2.02,;5.21,-3.35,;4.82,-1.86,;4.07,-2.17,;1.36,-2.02,;.59,-3.35,;.59,-.68,;-.95,-.68,;-1.85,-1.93,;-3.32,-1.45,;-4.65,-2.22,;-5.98,-1.45,;-5.98,.09,;-4.65,.86,;-3.32,.09,;-1.85,.56,;-1.08,1.9,;.38,2.37,;.38,3.91,;-1.08,4.39,;-1.99,3.14,;1.72,4.68,;3.26,4.68,;2.49,6.02,)|

BDBM312432

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2C[C@@H](CCc2c1-c1nc(no1)C1CC1)C(F)(F)F |r,wD:18.36,t:3,(3.12,-13.93,;4.66,-13.93,;5.43,-15.26,;5.43,-12.59,;4.66,-11.26,;5.43,-9.93,;6.97,-9.93,;7.74,-11.26,;6.97,-12.59,;5.84,-11.59,;6.43,-11.02,;3.12,-11.26,;2.35,-12.59,;2.35,-9.93,;.81,-9.93,;-.1,-11.17,;-1.56,-10.7,;-2.9,-11.47,;-4.23,-10.7,;-4.23,-9.16,;-2.9,-8.39,;-1.56,-9.16,;-.1,-8.68,;.67,-7.35,;2.14,-6.87,;2.14,-5.33,;.67,-4.86,;-.23,-6.1,;3.47,-4.56,;4.96,-4.16,;3.87,-3.07,;-5.56,-11.47,;-6.9,-10.7,;-5.56,-13.01,;-6.9,-12.24,)|

BDBM312431

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2C[C@H](CCc2c1-c1nc(no1)C1CC1)C(F)(F)F |r,wU:18.36,t:3,(3.12,-13.93,;4.66,-13.93,;5.43,-15.26,;5.43,-12.59,;4.66,-11.26,;5.43,-9.93,;6.97,-9.93,;7.74,-11.26,;6.97,-12.59,;5.84,-11.59,;6.43,-11.02,;3.12,-11.26,;2.35,-12.59,;2.35,-9.93,;.81,-9.93,;-.1,-11.17,;-1.56,-10.7,;-2.9,-11.47,;-4.23,-10.7,;-4.23,-9.16,;-2.9,-8.39,;-1.56,-9.16,;-.1,-8.68,;.67,-7.35,;2.14,-6.87,;2.14,-5.33,;.67,-4.86,;-.23,-6.1,;3.47,-4.56,;4.96,-4.16,;3.87,-3.07,;-5.56,-11.47,;-6.9,-10.7,;-5.56,-13.01,;-6.9,-12.24,)|

BDBM312333

OC(=O)C1=C(C2CCC1CC2)C(=O)Nc1sc2ccccc2c1-c1nc(no1)C1CC1 |t:3,(1.36,-4.68,;2.9,-4.68,;3.67,-6.02,;3.67,-3.35,;2.9,-2.02,;3.67,-.68,;5.21,-.68,;5.98,-2.02,;5.21,-3.35,;4.82,-1.86,;4.07,-2.17,;1.36,-2.02,;.59,-3.35,;.59,-.68,;-.95,-.68,;-1.85,-1.93,;-3.32,-1.45,;-4.65,-2.22,;-5.98,-1.45,;-5.98,.09,;-4.65,.86,;-3.32,.09,;-1.85,.56,;-1.08,1.9,;.38,2.37,;.38,3.91,;-1.08,4.39,;-1.99,3.14,;1.72,4.68,;3.26,4.68,;2.49,6.02,)|

BDBM234693

OC(=O)C1=C(CCC1)C(=O)Nc1sc(CC(F)(F)F)cc1-c1nc(no1)C1CC1 |t:3|

BDBM234690

OC(=O)C1=C(CCC1)C(=O)Nc1sc(cc1-c1nc(no1)C1CC1)C1CC1 |t:3|

BDBM312372

OC(=O)C1=C(CCC1)C(=O)Nc1sc2C3CCC(C3)c2c1-c1nc(no1)C1CC1 |t:3|

BDBM312426

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CC(CCc2c1-c1nc(no1)C1CC1)C(F)(F)F |t:3|

BDBM312401

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312398

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312452

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(ns1)C1CC1 |t:3|

BDBM312454

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CC(F)CCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312380

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312377

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312484

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCc2c1-c1ccc(Cl)cn1 |t:3|

BDBM312483

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCc2c1-c1cccc(Cl)n1 |t:3|

BDBM312338

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCc2c1-c1nc(cs1)C(F)(F)F |t:3|

BDBM312313

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312247

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312460

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCc2c1-c1nc(ns1)C1CC1 |t:3|

BDBM312260

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCc2c1-c1ncccn1 |t:3|

BDBM312262

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCCc2c1-c1ncon1 |t:3|

BDBM312389

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312386

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312473

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCOCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312464

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312343

OC(=O)C1=C(CCC1)C(=O)Nc1sc2COCCc2c1-c1nc(cs1)C(F)(F)F |t:3|

BDBM312350

OC(=O)C1=C(CCC1)C(=O)Nc1sc2COCCc2c1-c1nc(cs1)C1CC1 |t:3|

BDBM312323

OC(=O)C1=C(CCC1)C(=O)Nc1sc2COCCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312307

OC(=O)C1=C(CCC1)C(=O)Nc1sc2COCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312334

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CS(=O)(=O)CCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312501

OC(=O)C1=C(CCC1)C(=O)Nc1sc2CS(=O)(=O)CCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312428

OC(=O)C1=C(CCC1)C(=O)Nc1sc2C[C@@H](CCc2c1-c1nc(no1)C1CC1)C(F)(F)F |r,t:3|

BDBM312427

OC(=O)C1=C(CCC1)C(=O)Nc1sc2C[C@H](CCc2c1-c1nc(no1)C1CC1)C(F)(F)F |r,t:3|

BDBM312471

OC(=O)C1=C(CCC1)C(=O)Nc1sc2OCCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312240

OC(=O)C1=C(CCC1)C(=O)Nc1sc2ccccc2c1-c1ccccc1 |t:3|

BDBM312248

OC(=O)C1=C(CCC1)C(=O)Nc1sc2ccccc2c1-c1nc(no1)C1CC1 |t:3|

BDBM234691

OC(=O)C1=C(CCC1)C(=O)Nc1scc(C2CC2)c1-c1nc(no1)C1CC1 |t:3|

BDBM234694

OC(=O)C1=C(CCC1)C(=O)Nc1scc(c1-c1nc(no1)C1CC1)C(F)(F)F |t:3|

BDBM234669

OC(=O)C1=C(CCC1)C(=O)Nc1sccc1-c1ccccc1 |t:3|

BDBM234684

OC(=O)C1=C(CCC1)C(=O)Nc1sccc1-c1nc(no1)C1CC1 |t:3|

BDBM312429

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CC(CCc2c1-c1nc(no1)C1CC1)C(F)(F)F |t:3|

BDBM312402

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312399

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312453

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(ns1)C1CC1 |t:3|

BDBM312457

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CC(F)CCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312381

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312378

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312340

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCCCc2c1-c1nc(cs1)C(F)(F)F |t:3|

BDBM312493

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312461

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCCCc2c1-c1nc(ns1)C1CC1 |t:3|

BDBM312263

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCCCc2c1-c1ncccn1 |t:3|

BDBM312390

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCCc2c1-c1nc(no1)C(F)(F)F |t:3|

BDBM312387

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312474

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2CCOCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312344

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2COCCc2c1-c1nc(cs1)C(F)(F)F |t:3|

BDBM312361

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2COCCc2c1-c1nc(cs1)C1CC1 |t:3|

BDBM312503

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2C[C@@H](F)CCc2c1-c1nc(no1)C1CC1 |r,t:3|

BDBM312504

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2C[C@H](F)CCc2c1-c1nc(no1)C1CC1 |r,t:3|

BDBM312470

OC(=O)C1=C(CCCC1)C(=O)Nc1sc2OCCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312506

OC(=O)C1=C(CCOC1)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312500

OC(=O)C1=C(CCOC1)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312505

OC(=O)C1=C(COCC1)C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM312499

OC(=O)C1=C(COCC1)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |t:3|

BDBM50187486

OC(=O)C1C2CC(Sc3ccccc3[N+]([O-])=O)C(Cl)C2c2cccc3C4C=CCC4CN1c23 |c:28|

BDBM50187488

OC(=O)C1C2CC=CC2c2cc(Br)cc3C4C=CCC4CN1c23 |c:6,17|

BDBM50187490

OC(=O)C1C2CC=CC2c2cc(Cl)cc3C4C=CCC4CN1c23 |c:6,17|

BDBM263024

OC(=O)C1CCCCN1C(=O)Nc1ccccc1-c1ccccc1

BDBM263030

OC(=O)C1SCCN1C(=O)Nc1ccccc1-c1ccccc1

BDBM312280

OC(=O)CC1CCCN1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1

BDBM50429948

OC(=O)CCCCCCOc1ccccc1-c1cc(-c2ccc(Cl)cc2)n(n1)-c1ccccc1

BDBM50468363

OC(=O)CCCCCNS(=O)(=O)c1cc(Cl)cc(Cl)c1

BDBM50468362

OC(=O)CCCCNS(=O)(=O)c1cc(Cl)cc(Cl)c1

BDBM50468365

OC(=O)CCCCNS(=O)(=O)c1ccc(Br)c2ccccc12

BDBM50468388

OC(=O)CCCCNS(=O)(=O)c1ccc(Cl)c2ccccc12

BDBM50468364

OC(=O)CCCCNS(=O)(=O)c1ccc(F)c2ccccc12

BDBM50429943

OC(=O)CCCCOc1ccccc1-c1cc(-c2ccc(Br)cc2)n(n1)-c1ccccc1

BDBM50429949

OC(=O)CCCCOc1ccccc1-c1cc(-c2ccc(Cl)cc2)n(n1)-c1ccccc1

BDBM50429945

OC(=O)CCCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccccc1

BDBM50002838

OC(=O)CCCCOc1ccccc1-c1nc(c(o1)-c1ccccc1)-c1ccccc1

BDBM50152858

OC(=O)CCCCn1c2ccccc2c2ccccc12

BDBM50468384

OC(=O)CCCNC(=O)c1cc(Cl)cc(Cl)c1

BDBM50468361

OC(=O)CCCNS(=O)(=O)c1cc(Cl)cc(Cl)c1

BDBM451169

OC(=O)CCCOc1ccc(F)cc1-c1cc(-c2ccccc2)n(n1)-c1ccccc1

BDBM451175

OC(=O)CCCOc1ccc(F)cc1-c1cc(-c2ccccc2Cl)n(n1)-c1ccccc1

BDBM50429946

OC(=O)CCCOc1ccccc1-c1cc(-c2ccc(Br)cc2)n(n1)-c1ccccc1

BDBM50429950

OC(=O)CCCOc1ccccc1-c1cc(-c2ccc(Cl)cc2)n(n1)-c1ccccc1

BDBM50429933

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccc(Br)cc1

BDBM451163

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccc(Cl)c(Cl)c1

BDBM50429932

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccc(Cl)cc1

BDBM50429934

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccc(F)cc1

BDBM50429939

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)-c1cccc(Cl)c1

BDBM50429935

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccccc1

BDBM50429940

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccccc1Cl

BDBM50429938

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)C1CCCC1

BDBM50429937

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)C1CCCCC1

BDBM50429936

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2)n(n1)C1CCCCCC1

BDBM451164

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2Br)n(n1)-c1ccccc1

BDBM451161

OC(=O)CCCOc1ccccc1-c1cc(-c2ccccc2Cl)n(n1)-c1ccccc1

BDBM50152851

OC(=O)CCCn1c2ccccc2c2ccccc12

BDBM50468387

OC(=O)CCNS(=O)(=O)c1cc(Cl)cc(Cl)c1

BDBM50248246

OC(=O)CC\C=C/c1nn(c2CCCc12)-c1ccccc1

BDBM50177673

OC(=O)CCn1c(c(-c2ccccc2)c2cc(ccc12)C1CC1)-c1ccccc1

BDBM50177672

OC(=O)CCn1c(cc2ccccc12)-c1ccccc1

BDBM50152856

OC(=O)CCn1c2ccccc2c2ccccc12

BDBM50212872

OC(=O)CNc1cccc(c1)-c1ccccc1-c1nc(c(-c2ccccc2)n1CC(O)=O)-c1ccccc1

BDBM50212874

OC(=O)CNc1cccc(c1)-c1ccccc1-c1nc(c([nH]1)-c1ccccc1)-c1ccccc1

BDBM50346467

OC(=O)COc1cccc(c1)-c1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccc(Cl)cc1

BDBM50346466

OC(=O)COc1cccc(c1)-c1ccccc1-c1cc(-c2ccccc2)n(n1)-c1ccccc1

BDBM50346468

OC(=O)COc1cccc(c1)-c1ccccc1-c1cc(-c2ccco2)n(n1)-c1ccc(Cl)cc1

BDBM50346469

OC(=O)COc1cccc(c1)-c1ccccc1-c1cc(-c2cccs2)n(n1)-c1ccc(Cl)cc1

BDBM50212887

OC(=O)COc1cccc(c1)-c1ccccc1-c1cc(c([nH]1)-c1ccccc1)-c1ccccc1

BDBM50212878

OC(=O)COc1cccc(c1)-c1ccccc1-c1cc(c(o1)-c1ccccc1)-c1ccccc1

BDBM50212883

OC(=O)COc1cccc(c1)-c1ccccc1-c1nc(c(-c2ccccc2)n1CCF)-c1ccccc1

BDBM50212879

OC(=O)COc1cccc(c1)-c1ccccc1-c1nc(c([nH]1)-c1ccccc1)-c1ccccc1

BDBM50029969

OC(=O)COc1cccc(c1)-c1ccccc1-c1nc(c(o1)-c1ccccc1)-c1ccccc1

BDBM50429951

OC(=O)COc1ccccc1-c1cc(-c2ccc(Cl)cc2)n(n1)-c1ccccc1

BDBM50319700

OC(=O)CSCC(=O)NCc1c(Cl)cccc1Oc1ccccc1

BDBM50319699

OC(=O)CSCC(=O)NCc1ccccc1N1CCCCC1

BDBM50319701

OC(=O)CSCC(=O)Nc1cc(Cl)cc(Cl)c1

BDBM50319698

OC(=O)CSCC(=O)Nc1ccc(F)c(Cl)c1

BDBM53262

OC(=O)CSc1cc(NS(=O)(=O)c2ccc(Cl)cc2)c2ccccc2c1O

BDBM50192463

OC(=O)Cc1cccc(OCc2ccccc2Cl)c1OCc1ccccc1Cl

BDBM50590450

OC(=O)Cc1cn(nn1)-c1ccccc1-c1nc(c(s1)-c1ccccc1)-c1ccc(Cl)cc1

BDBM50590449

OC(=O)Cc1cn(nn1)-c1ccccc1-c1nc(c(s1)-c1ccccc1)-c1ccc2ccccc2c1

BDBM50590448

OC(=O)Cc1cn(nn1)-c1ccccc1-c1nc(c(s1)-c1ccccc1)-c1ccccc1

BDBM50152869

OC(=O)Cn1c2ccccc2c2ccccc12

BDBM312411

OC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312284

OC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312415

OC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1sc2CCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312360

OC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1sc2COCCc2c1-c1nc(no1)C(F)(F)F |r|

BDBM312368

OC(=O)[C@@H]1CCCC[C@H]1C(=O)Nc1sc2COCCc2c1-c1nc(no1)C(F)(F)F |r|

BDBM312512

OC(=O)[C@@H]1CCCN1C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312305

OC(=O)[C@@H]1CCCN1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM263050

OC(=O)[C@@H]1CCN1C(=O)Nc1cc(Cl)ccc1-c1ccccc1 |r|

BDBM263032

OC(=O)[C@@H]1[C@H]2C[C@H]2CN1C(=O)Nc1ccccc1-c1ccccc1 |r|

BDBM312481

OC(=O)[C@@]12C[C@@]1(CCC2)C(=O)Nc1sc2COCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312281

OC(=O)[C@H]1CCCCN1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312408

OC(=O)[C@H]1CCCC[C@@H]1C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C1CC1 |r|

BDBM312412

OC(=O)[C@H]1CCCC[C@@H]1C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312416

OC(=O)[C@H]1CCCC[C@@H]1C(=O)Nc1sc2CCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312370

OC(=O)[C@H]1CCCC[C@H]1C(=O)Nc1sc2COCCc2c1-c1nc(no1)C(F)(F)F |r|

BDBM263034

OC(=O)[C@H]1CCCN1C(=O)Nc1c(F)cccc1-c1ccccc1 |r|

BDBM263044

OC(=O)[C@H]1CCCN1C(=O)Nc1c(sc2ccccc12)-c1ccccc1 |r|

BDBM263045

OC(=O)[C@H]1CCCN1C(=O)Nc1c(sc2ncccc12)-c1ccccc1 |r|

BDBM263042

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)cc(-c2ccccc2)c1-c1ccccc1 |r|

BDBM263048

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)cc(C#N)c1-c1ccccc1 |r|

BDBM263049

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)cc(C2=CCCCC2)c1-c1ccccc1 |r,t:18|

BDBM263046

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)cc(CC=C)c1-c1ccccc1 |r|

BDBM263041

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)cc(Cl)c1-c1ccccc1 |r|

BDBM263066

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1-c1ccc(Cl)cc1 |r|

BDBM263061

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1-c1ccc(F)cc1 |r|

BDBM263062

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1-c1cccc(Cl)c1 |r|

BDBM263033

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1-c1ccccc1 |r|

BDBM263065

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1-c1ccncc1 |r|

BDBM263059

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1-c1ccsc1 |r|

BDBM263060

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1-c1csc2ccccc12 |r|

BDBM263064

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1C1=CCCCC1 |r,t:20|

BDBM263028

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1Oc1ccccc1 |r|

BDBM263037

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(F)cc(F)c1-c1ccccc1 |r|

BDBM263039

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(F)ccc1-c1ccccc1 |r|

BDBM263040

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(OC(F)(F)F)ccc1-c1ccccc1 |r|

BDBM263043

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(ccc1-c1ccccc1)C#N |r|

BDBM263036

OC(=O)[C@H]1CCCN1C(=O)Nc1cc(ccc1-c1ccccc1)C(F)(F)F |r|

BDBM263025

OC(=O)[C@H]1CCCN1C(=O)Nc1ccc(Cl)cc1-c1ccccc1 |r|

BDBM263027

OC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1Cc1ccccc1 |r|

BDBM263026

OC(=O)[C@H]1CCCN1C(=O)Nc1ccccc1Oc1ccccc1 |r|

BDBM263047

OC(=O)[C@H]1CCCN1C(=O)Nc1ccsc1-c1ccccc1 |r|

BDBM312462

OC(=O)[C@H]1CCCN1C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C1CC1 |r|

BDBM312510

OC(=O)[C@H]1CCCN1C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C(F)(F)F |r|

BDBM312467

OC(=O)[C@H]1CCCN1C(=O)Nc1sc2CCCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312511

OC(=O)[C@H]1CCCN1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C(F)(F)F |r|

BDBM312277

OC(=O)[C@H]1CCCN1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM312463

OC(=O)[C@H]1CCCN1C(=O)Nc1sc2CCCc2c1-c1nc(no1)C1CC1 |r|

BDBM263053

OC(=O)[C@H]1CCN1C(=O)Nc1cc(Cl)c(F)cc1-c1ccccc1 |r|

BDBM263058

OC(=O)[C@H]1CCN1C(=O)Nc1cc(Cl)ccc1-c1cc(F)cc(F)c1 |r|

BDBM263052

OC(=O)[C@H]1CCN1C(=O)Nc1cc(Cl)ccc1-c1ccc(F)cc1 |r|

BDBM263070

OC(=O)[C@H]1CCN1C(=O)Nc1cc(Cl)ccc1-c1ccc(F)cc1F |r|

BDBM263057

OC(=O)[C@H]1CCN1C(=O)Nc1cc(Cl)ccc1-c1cccc(F)c1 |r|

BDBM263055

OC(=O)[C@H]1CCN1C(=O)Nc1cc(Cl)ccc1-c1cccc(F)c1F |r|

BDBM263035

OC(=O)[C@H]1CCN1C(=O)Nc1cc(Cl)ccc1-c1ccccc1 |r|

BDBM263056

OC(=O)[C@H]1CCN1C(=O)Nc1cc(Cl)ccc1-c1ccccc1F |r|

BDBM263051

OC(=O)[C@H]1CCN1C(=O)Nc1ccccc1-c1ccccc1 |r|

BDBM312282

OC(=O)[C@H]1CCN1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1 |r|

BDBM263031

OC(=O)[C@H]1CSCN1C(=O)Nc1ccccc1-c1ccccc1 |r|

BDBM50381857

OC(=O)\C=C\c1cn(Cc2ccccc2F)c2ccccc12

BDBM50197086

OC(=O)c1c(nc2c(Cl)cc(Cl)cc2c1-c1ccccc1)N1CCCCC1

BDBM50197094

OC(=O)c1c(nc2ccc(Cl)cc2c1-c1ccccc1)N1CCCCC1

BDBM50574781

OC(=O)c1cc(NS(=O)(=O)c2ccc(-c3ccc(F)c(Cl)c3)c3ccccc23)ccc1F

BDBM50574774

OC(=O)c1cc(NS(=O)(=O)c2ccc(-c3ccc(F)cc3)c3ccccc23)ccc1F

BDBM50574778

OC(=O)c1cc(NS(=O)(=O)c2ccc(-c3ccc(F)cc3Cl)c3ccccc23)ccc1F

BDBM50574779

OC(=O)c1cc(NS(=O)(=O)c2ccc(-c3ccc(F)cc3F)c3ccccc23)ccc1F

BDBM50574775

OC(=O)c1cc(NS(=O)(=O)c2ccc(-c3ccc(O)cc3)c3ccccc23)ccc1F

BDBM50574773

OC(=O)c1cc(NS(=O)(=O)c2ccc(-c3ccccc3)c3ccccc23)ccc1F

BDBM50574776

OC(=O)c1cc(NS(=O)(=O)c2ccc(-c3ccccc3OC(F)(F)F)c3ccccc23)ccc1F

BDBM50525634

OC(=O)c1cc(NS(=O)(=O)c2ccc(OC3CCCCC3)c3ccccc23)ccc1F

BDBM50525619

OC(=O)c1cc(NS(=O)(=O)c2ccc(OC3CCCCCC3)c3ccccc23)ccc1F

BDBM50525626

OC(=O)c1cc(NS(=O)(=O)c2ccc(OCC34CC5CC(CC(C5)C3)C4)c3ccccc23)ccc1F |THB:15:16:19:23.21.22,21:20:17:23.22.24,21:22:19.20.25:17,24:22:19:25.16.17,24:16:19:23.21.22|

BDBM50525635

OC(=O)c1cc(NS(=O)(=O)c2ccc(OCC3CCCCC3)c3ccccc23)ccc1F

BDBM50525639

OC(=O)c1cc(NS(=O)(=O)c2ccc(OCCC3CCCCC3)c3ccccc23)ccc1F

BDBM50525640

OC(=O)c1cc(NS(=O)(=O)c2ccc(OCCCC3CCCCC3)c3ccccc23)ccc1F

BDBM50525627

OC(=O)c1cc(NS(=O)(=O)c2ccc(OCc3ccccc3)c3ccccc23)ccc1F

BDBM50247988

OC(=O)c1ccc2c3CCCCc3n(Cc3ccccc3)c2c1

BDBM50247989

OC(=O)c1ccc2n(Cc3ccccc3)c3CCCCc3c2c1

BDBM50590447

OC(=O)c1cccc(NS(=O)(=O)c2ccc(Br)c3ccccc23)c1

BDBM50212876

OC(=O)c1cccc(OCc2ccc(Cl)cc2Cl)c1OCc1ccc(Cl)cc1Cl

BDBM50187493

OC(=O)c1cccc2C3C(Cl)C(CC3C(Nc12)c1ccccc1[N+]([O-])=O)Sc1ccccc1[N+]([O-])=O

BDBM50248194

OC(=O)c1cccc2c3C(CCCc3n(Cc3ccccc3)c12)N=O

BDBM50247995

OC(=O)c1cccc2c3CCCCCc3n(Cc3ccc(F)cc3)c12

BDBM50248243

OC(=O)c1cccc2c3CCCCCc3n(Cc3ccc(cc3)C(F)(F)F)c12

BDBM50247994

OC(=O)c1cccc2c3CCCCCc3n(Cc3cccc(F)c3)c12

BDBM50248242

OC(=O)c1cccc2c3CCCCCc3n(Cc3cccc(c3)C(F)(F)F)c12

BDBM50248191

OC(=O)c1cccc2c3CCCCCc3n(Cc3ccccc3)c12

BDBM50247996

OC(=O)c1cccc2c3CCCCCc3n(Cc3ccccc3C(F)(F)F)c12

BDBM50247993

OC(=O)c1cccc2c3CCCCCc3n(Cc3ccccc3F)c12

BDBM50247971

OC(=O)c1cccc2c3CCCCc3n(Cc3c(F)cccc3C(F)(F)F)c12

BDBM50248240

OC(=O)c1cccc2c3CCCCc3n(Cc3ccc(F)cc3)c12

BDBM50247969

OC(=O)c1cccc2c3CCCCc3n(Cc3ccc(cc3)C(F)(F)F)c12

BDBM50247968

OC(=O)c1cccc2c3CCCCc3n(Cc3cccc(c3)C(F)(F)F)c12

BDBM50247987

OC(=O)c1cccc2c3CCCCc3n(Cc3ccccc3)c12

BDBM50247990

OC(=O)c1cccc2c3CCCc3n(Cc3ccccc3)c12

BDBM50248193

OC(=O)c1cccc2c3c(CCCC3=O)n(Cc3ccccc3)c12

BDBM50187492

OC(=O)c1ccccc1N\N=C(/C(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1ccccc1

BDBM50538223

OC(=O)c1ccccc1Nc1cccc(Br)c1-c1ccccc1

BDBM50538235

OC(=O)c1ccccc1Nc1cccc(Cl)c1-c1ccc2OCCc2c1

BDBM50538234

OC(=O)c1ccccc1Nc1cccc(Cl)c1-c1ccc2OCOc2c1

BDBM50538232

OC(=O)c1ccccc1Nc1cccc(Cl)c1-c1ccc2[nH]ncc2c1

BDBM50538228

OC(=O)c1ccccc1Nc1cccc(Cl)c1-c1ccc2ccccc2c1

BDBM50538233

OC(=O)c1ccccc1Nc1cccc(Cl)c1-c1ccc2nonc2c1

BDBM50538236

OC(=O)c1ccccc1Nc1cccc(Cl)c1-c1ccc2occc2c1

BDBM50538229

OC(=O)c1ccccc1Nc1cccc(Cl)c1-c1ccccc1

BDBM50538224

OC(=O)c1ccccc1Nc1cccc(c1-c1ccccc1)C(F)(F)F

BDBM50337278

OC(=O)c1ccccc1Nc1ccccc1

BDBM35919

OC(=O)c1ccccc1Nc1ccccc1-c1ccccc1

BDBM50538222

OC(=O)c1ccccc1Nc1ccccc1Nc1ccccc1

BDBM35913

OC(=O)c1ccccc1Nc1ccccc1Oc1ccccc1

BDBM50538221

OC(=O)c1ccccc1Oc1ccccc1

BDBM50152853

OC(=O)c1ccccc1S(=O)(=O)n1c2ccccc2c2ccccc12

BDBM50152867

OC(=O)c1ccccc1S(=O)(=O)n1ccc2c(F)cccc12

BDBM50152870

OC(=O)c1ccccc1S(=O)(=O)n1ccc2cc(Br)ccc12

BDBM312495

OC(=O)c1cccnc1C(=O)Nc1sc2CC(F)(F)CCc2c1-c1nc(no1)C(F)(F)F

BDBM312496

OC(=O)c1cccnc1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C(F)(F)F

BDBM312296

OC(=O)c1cccnc1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1

BDBM312480

OC(=O)c1cccnc1C(=O)Nc1sc2COCCc2c1-c1nc(no1)C1CC1

BDBM312449

OC(=O)c1ccncc1C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1

BDBM312448

OC(=O)c1ccncc1C(=O)Nc1sc2COCCc2c1-c1nc(no1)C1CC1

BDBM312479

OC(=O)c1ncccc1C(=O)Nc1sc2COCCc2c1-c1nc(no1)C1CC1

BDBM312266

OC(=O)c1nccnc1C(=O)Nc1sc2CCCCc2c1-c1ncccn1

BDBM50152857

OC(=O)c1sccc1S(=O)(=O)n1c2ccccc2c2ccccc12

BDBM50152852

OC(=O)c1sccc1S(=O)(=O)n1ccc2cc(Br)ccc12

BDBM50152863

OC(=O)c1sccc1S(=O)(=O)n1ccc2cc(F)ccc12

BDBM50152859

OC(=O)c1sccc1S(=O)(=O)n1ccc2ccc(F)cc12

BDBM50152860

OC(=O)c1sccc1S(=O)(=O)n1ccc2cccc(F)c12

BDBM50192464

OCC(O)c1cccc(OCc2ccccc2Cl)c1OCc1ccccc1Cl

BDBM60927

OS(=O)(=O)c1cccc2cccc(Nc3ccccc3)c12

BDBM312469

O[C@@H]1C[C@@H](N(C1)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1)C(O)=O |r|

BDBM50192462

O[C@H](C(O)=O)c1cccc(OCc2ccccc2Cl)c1OCc1ccccc1Cl

BDBM312468

O[C@H]1C[C@@H](N(C1)C(=O)Nc1sc2CCCCc2c1-c1nc(no1)C1CC1)C(O)=O |r|

BDBM50319704

[O-][N+](=O)c1ccc(cc1OS(=O)(=O)c1cc(Cl)cc(Cl)c1)S(=O)(=O)c1ccccc1