SMILES for ATPase family AAA domain-containing protein 2

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCCNC(C)=O)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O |r|

BDBM50547687

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCNC(C)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](N)CO)C(O)=O |r|

BDBM50514896

CC(C)N1CCc2c(C1)nnn2CC(=O)Nc1ccc(Br)c(c1)S(=O)(=O)N1CC[C@H](C)C1 |r|

BDBM50098313

CC(C)O[C@@H]1CNCC[C@H]1Nc1nccc2cc(C)c(=O)[nH]c12 |r|

BDBM50560181

CC(C)[C@@H](C)NC(=O)[C@@H]1CNCC[C@H]1Nc1nccc2cc(C)c(=O)[nH]c12 |r|

BDBM50514891

CC1(C)CCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl

BDBM50030937

CC1(C)CNC(=O)c2sc(N)nc2C1

BDBM50514882

CC1(C)NC(=O)N(CC(=O)Nc2ccc(Cl)c(c2)S(=O)(=O)N2CCCC2)C1=O

BDBM50504159

CC1(NC(=O)N(CC(=O)Nc2ccc(Br)c(c2)S(=O)(=O)N2CCCCC2)C1=O)C1CC1

BDBM50514883

CC1(NC(=O)N(CC(=O)Nc2ccc(Cl)c(c2)S(=O)(=O)N2CCCC2)C1=O)C1CC1

BDBM50504137

CC1(NC(=O)N(CC(=O)Nc2ccc(Cl)c(c2)S(=O)(=O)N2CCCCC2)C1=O)C1CC1

BDBM50504153

CC1(NC(=O)N(CC(=O)Nc2ccc(c(c2)S(=O)(=O)N2CCCCC2)C(F)(F)F)C1=O)C1CC1

BDBM50504146

CC1(NC(=O)N(CC(=O)Nc2cccc(c2)S(=O)(=O)N2CCCCC2)C1=O)C1CC1

BDBM50584947

CC1=C(C#N)c2nc(N)c(C#N)c(C)c2\C1=C/c1ccc(o1)-c1cc(ccc1Cl)C(O)=O |c:1|

BDBM50504158

CC1CCCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Br

BDBM50514850

CC1CCCN1S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl

BDBM50514866

CC1NC(=O)N(CC(=O)Nc2ccc(Cl)c(c2)S(=O)(=O)N2CCCC2)C1=O

BDBM50504150

CCC(=O)Nc1ccc(Br)c(c1)S(=O)(=O)N1CCCCC1

BDBM50504161

CCC(=O)Nc1ccc(C#N)c(c1)S(=O)(=O)N1CCCCC1

BDBM50504168

CCC(=O)Nc1ccc(CC)c(c1)S(=O)(=O)N1CCCCC1

BDBM50504164

CCC(=O)Nc1ccc(Cl)c(c1)S(=O)(=O)N1CCCCC1

BDBM50504147

CCC(=O)Nc1ccc(F)c(c1)S(=O)(=O)N1CCCCC1

BDBM50504163

CCC(=O)Nc1ccc(N)c(c1)S(=O)(=O)N1CCCCC1

BDBM50504148

CCC(=O)Nc1ccc(O)c(c1)S(=O)(=O)N1CCCCC1

BDBM50504149

CCC(=O)Nc1ccc(OC)c(c1)S(=O)(=O)N1CCCCC1

BDBM50504165

CCC(=O)Nc1ccc(c(c1)S(=O)(=O)N1CCCCC1)C(F)(F)F

BDBM50514893

CCC1CCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl

BDBM50150069

CCCCc1c(C)nc2nc(SCc3nc4n(CCCC)c(=O)[nH]c(=O)c4n3CC)nn2c1C

BDBM50093463

CCCNc1cccc2cc(C)c(=O)[nH]c12

BDBM50098314

CCCO[C@@H]1CNCC[C@H]1Nc1nccc2cc(C)c(=O)[nH]c12 |r|

BDBM50514888

CCCc1cn(CC(=O)Nc2ccc(Br)c(c2)S(=O)(=O)N2CC[C@H](C)C2)nn1 |r|

BDBM50514892

CCCc1cnnn1CC(=O)Nc1ccc(Br)c(c1)S(=O)(=O)N1CC[C@H](C)C1 |r|

BDBM50504138

CCN(CC)S(=O)(=O)c1cc(NC(=O)CN2C(=O)NC(C)(C2=O)c2ccccc2)ccc1C

BDBM50030940

CCN1C(=O)CCc2cc(N)ccc12

BDBM50514878

CCN1CCc2c(C1)nnn2CC(=O)Nc1ccc(Br)c(c1)S(=O)(=O)N1CC[C@H](C)C1 |r|

BDBM50365463

CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12 |r,t:7|

BDBM50504160

CCOC(=O)Nc1cc(nn2c(C)nnc12)-c1ccc(C)c(NS(C)(=O)=O)c1

BDBM50158627

CCOc1ccc(cc1-c1cn(C)c(=O)c2ccc(cc12)-c1cnn(C)c1)S(=O)(=O)CC

BDBM50539801

CCS(=O)(=O)Nc1cc(cc2n(ccc12)C(C)(c1ccccn1)c1ccccn1)-c1cn(C)c2c1cc[nH]c2=O

BDBM50098307

CCc1cc2c(cnc(N[C@@H]3CCNC[C@H]3OCC3CCS(=O)(=O)CC3)c2[nH]c1=O)-c1cncc(C)c1 |r|

BDBM50249797

CCc1cc2cc(NS(=O)(=O)c3ccc(cc3)C#N)ccc2n(CC)c1=O

BDBM50093455

CN(C)CC(C)(C)CNc1nccc2cc(C)c(=O)[nH]c12

BDBM50514855

CN(C)CC1CCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl

BDBM50093470

CN(C)CCCNc1cccc2cc(C)c(=O)[nH]c12

BDBM50093444

CN(C)CCCNc1nccc2cc(C)c(=O)[nH]c12

BDBM50093462

CN(C)CCNc1cccc2cc(C)c(=O)[nH]c12

BDBM50093469

CN(C)CCNc1nccc2cc(C)c(=O)[nH]c12

BDBM50514860

CN(C)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl

BDBM50504142

CN(C)S(=O)(=O)c1cc(NC(=O)CN2C(=O)NC3(CCCc4ccccc34)C2=O)ccc1Cl

BDBM50504144

CN1CC(=O)N(CC(=O)Nc2ccc(C)c(c2)S(=O)(=O)N2CCCCC2)C1=O

BDBM50572120

CN1CCC(CC1)Nc1ncc(-c2cncc(C)c2)c2cc(C)c(=O)[nH]c12

BDBM50093460

CN1CCC(CC1)Nc1nccc2cc(C)c(=O)[nH]c12

BDBM50504166

CN1CCN(CC1)c1nc(C(=O)c2ccccc2)c2cnn(C)c2n1

BDBM50560174

CN1CC[C@@H](Nc2ncc(-c3ccco3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)C(=O)NC1CCCCC1

BDBM50098311

CN1CC[C@@H](Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)[C@@H](C1)OCC1CCS(=O)(=O)CC1 |r|

BDBM50514856

CN1CCc2c(C1)nnn2CC(=O)Nc1ccc(Br)c(c1)S(=O)(=O)N1CC[C@@H](C1)C1CC1 |r|

BDBM50514853

CN1CCc2c(C1)nnn2CC(=O)Nc1ccc(Br)c(c1)S(=O)(=O)N1CC[C@H](C1)C1CC1 |r|

BDBM50514858

CN1CCc2c(C1)nnn2CC(=O)Nc1ccc(Cl)c(c1)S(=O)(=O)N1CC[C@@H](C1)C1CC1 |r|

BDBM50514854

CN1CCc2c(C1)nnn2CC(=O)Nc1ccc(Cl)c(c1)S(=O)(=O)N1CC[C@H](C1)C1CC1 |r|

BDBM50453949

CNC(=O)c1ccc(cn1)-c1cc2cccc(-c3nn(C4CCOCC4)c4CCN(Cc34)C(C)=O)c2cn1

BDBM50514881

COCC1CCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl

BDBM50096309

COCCCN1CCC(CC1)Nc1nccc2cc(C)c(=O)[nH]c12

BDBM50096310

COCCN1CCC(CC1)Nc1nccc2cc(C)c(=O)[nH]c12

BDBM50093467

COCCNc1cccc2cc(C)c(=O)[nH]c12

BDBM50514874

COCc1cn(CC(=O)Nc2ccc(Br)c(c2)S(=O)(=O)N2CC[C@H](C)C2)nn1 |r|

BDBM50514876

COCc1cnnn1CC(=O)Nc1ccc(Br)c(c1)S(=O)(=O)N1CC[C@H](C)C1 |r|

BDBM50560185

CO[C@@H](C)CNC(=O)[C@@H]1CNCC[C@H]1Nc1nccc2cc(C)c(=O)[nH]c12 |r|

BDBM50098312

CO[C@@H]1CNCC[C@H]1Nc1nccc2cc(C)c(=O)[nH]c12 |r|

BDBM50464133

CO[C@@H]1CNC[C@H](OC)[C@H]1Nc1nccc2cc(C)c(=O)[nH]c12 |r|

BDBM50464128

CO[C@H]1CNC[C@@H](OCC2CCC(F)(F)CC2)[C@@H]1Nc1ncc(-c2cncc(C)c2)c2cc(C)c(=O)[nH]c12 |r|

BDBM50464130

CO[C@H]1CNC[C@@H](OCC2CCOCC2)[C@@H]1Nc1ncc(-c2cncc(C)c2)c2cc(C)c(=O)[nH]c12 |r|

BDBM50464127

CO[C@H]1CNC[C@@H](OCC2CCS(=O)(=O)CC2)[C@@H]1Nc1ncc(-c2cncc(C)c2)c2cc(C)c(=O)[nH]c12 |r|

BDBM50520627

COc1cc(Cl)c(cc1-c1ccc(CN[C@H](C)c2ccc(C)cc2)o1)C(=O)N[C@@H](CN[C@@H]1CC[C@H](N)CC1)Cc1ccc(cc1)C#N |r,wU:31.33,34.37,15.16,wD:28.41,(53.24,-30.34,;54.54,-29.52,;54.48,-27.98,;55.78,-27.15,;55.71,-25.6,;57.01,-24.77,;54.34,-24.9,;53.05,-25.72,;53.11,-27.27,;51.81,-28.09,;51.72,-29.63,;50.23,-30.02,;49.4,-28.72,;47.87,-28.62,;47.01,-29.9,;45.48,-29.81,;44.79,-28.43,;44.62,-31.09,;43.09,-30.98,;42.23,-32.27,;42.92,-33.65,;42.07,-34.93,;44.46,-33.74,;45.31,-32.46,;50.38,-27.53,;54.27,-23.36,;55.57,-22.53,;52.9,-22.65,;52.83,-21.11,;54.13,-20.28,;54.06,-18.74,;55.36,-17.91,;56.72,-18.63,;58.02,-17.8,;57.95,-16.26,;59.25,-15.44,;56.59,-15.55,;55.28,-16.38,;51.47,-20.4,;50.17,-21.23,;48.81,-20.52,;47.51,-21.34,;47.58,-22.88,;48.96,-23.59,;50.25,-22.76,;46.29,-23.72,;44.99,-24.55,)|

BDBM50584926

COc1cc(cc(OC)c1O)C(=O)N1C2Cc3ccccc3C1CNC2=O |THB:11:13:16.21.15:25.24.23|

BDBM50092310

COc1cc2c(cc1-c1c(C)noc1C)[nH]c1ccnc(-c3c(C)[nH]nc3C3CC3)c21 |(5.34,2.95,;5.34,1.67,;3.96,.87,;2.62,1.63,;1.3,.87,;1.3,-.64,;2.62,-1.4,;3.96,-.64,;5.34,-1.44,;5.49,-3.01,;4.53,-3.86,;7.04,-3.34,;7.84,-1.97,;6.77,-.78,;7.03,.46,;,-1.4,;-1.3,-.64,;-2.64,-1.4,;-3.92,-.64,;-3.92,.87,;-2.64,1.63,;-2.66,3.22,;-3.96,4.12,;-5.16,3.71,;-3.48,5.64,;-1.89,5.66,;-1.38,4.15,;.14,3.67,;1.21,2.62,;1.55,4.18,;-1.3,.87,)|

BDBM179481

COc1cc2c(cc1-c1c(C)noc1C)[nH]c1nc(C)nc(-c3ccnc4ccccc34)c21 |(-1.5,3.22,;-2.13,1.81,;-1.36,.48,;.18,.48,;.95,-.85,;.18,-2.19,;-1.36,-2.19,;-2.13,-.85,;-3.67,-.85,;-4.57,-2.1,;-4.18,-3.59,;-6.04,-1.62,;-6.04,-.08,;-4.57,.39,;-4.18,1.88,;1.21,-3.33,;2.62,-2.71,;4.03,-3.33,;5.27,-2.43,;6.68,-3.05,;5.11,-.9,;3.7,-.27,;3.31,1.22,;1.84,1.69,;1.52,3.2,;2.66,4.23,;4.13,3.75,;5.27,4.79,;6.74,4.31,;7.06,2.8,;5.91,1.77,;4.45,2.25,;2.46,-1.17,)|

BDBM50366670

COc1cc2c(cc1-c1c(C)noc1C)[nH]c1nc(C)nc(Nc3cc(nn3C)C3CC3)c21 |(86.87,-46.33,;85.61,-45.43,;84.21,-46.07,;84.06,-47.6,;82.66,-48.24,;81.41,-47.34,;81.56,-45.82,;82.95,-45.18,;83.09,-43.65,;81.94,-42.63,;80.43,-42.97,;82.55,-41.22,;84.08,-41.36,;84.42,-42.87,;85.83,-43.48,;80.17,-48.26,;80.66,-49.73,;79.89,-51.06,;80.66,-52.39,;79.89,-53.73,;82.21,-52.4,;82.97,-51.06,;84.51,-51.06,;85.28,-52.39,;84.66,-53.8,;85.81,-54.83,;87.14,-54.06,;86.82,-52.56,;87.85,-51.41,;85.64,-56.36,;84.75,-57.61,;86.28,-57.77,;82.2,-49.71,)|

BDBM50380682

COc1cc2c3n([C@H](C)c4ccccn4)c(=O)[nH]c3cnc2cc1-c1c(C)noc1C |r,wD:7.7,(46.55,-39.62,;46.55,-41.16,;47.89,-41.93,;49.21,-41.16,;50.55,-41.92,;51.88,-41.15,;52.18,-39.65,;51.41,-38.32,;49.87,-38.32,;52.18,-36.98,;51.41,-35.66,;52.17,-34.32,;53.72,-34.32,;54.49,-35.66,;53.72,-36.99,;53.7,-39.47,;54.46,-38.13,;54.34,-40.87,;53.21,-41.9,;53.22,-43.46,;51.89,-44.23,;50.55,-43.47,;49.22,-44.25,;47.88,-43.47,;46.55,-44.24,;46.51,-45.79,;47.74,-46.72,;45.04,-46.23,;44.16,-44.97,;45.09,-43.74,;44.64,-42.27,)|

BDBM50504154

COc1ccc(NC(=O)CN2C(=O)NC(C)(C3CC3)C2=O)cc1S(=O)(=O)N1CCCCC1

BDBM50096302

COc1ccc(cn1)-c1cnc(NC2CCNCC2)c2[nH]c(=O)c(C)cc12

BDBM50030935

COc1ccc2nc(NC(=O)C(C)C)sc2c1

BDBM50543327

COc1cccc(c1)-c1sc(NC(=O)[C@@H](C)N)nc1C(C)=O |r|

BDBM50096282

COc1cncc(c1)-c1cnc(NC2CCNCC2)c2[nH]c(=O)c(C)cc12

BDBM50098302

COc1cncc(c1)-c1cnc(N[C@@H]2CCNC[C@H]2OCC2CCOCC2)c2[nH]c(=O)c(C)cc12 |r|

BDBM50098303

COc1cncc(c1)-c1cnc(N[C@@H]2CCNC[C@H]2OCC2CCS(=O)(=O)CC2)c2[nH]c(=O)c(C)cc12 |r|

BDBM50504141

CSCCC1NC(=O)N(CC(=O)Nc2ccc(Cl)c(c2)S(=O)(=O)N2CCOCC2)C1=O

BDBM50543330

C[C@@H](N)C(=O)Nc1nc(C(C)=O)c(s1)-c1cccc(N)c1 |r|

BDBM50543326

C[C@@H](N)C(=O)Nc1nc(C(C)=O)c(s1)-c1cccc(O)c1 |r|

BDBM50543329

C[C@@H](N)C(=O)Nc1nc(C(C)=O)c(s1)-c1cccnc1 |r|

BDBM50543328

C[C@@H](N)C(=O)Nc1nc(C(C)=O)c(s1)-c1cncc(N)c1 |r|

BDBM50543321

C[C@@H](N)C(=O)Nc1nc(cs1)C(C)=O |r|

BDBM50543325

C[C@@H](N)C(=O)Nc1nc2c(CCCC2=O)s1 |r|

BDBM50543333

C[C@@H](NC(N)=N)C(=O)Nc1nc(C(C)=O)c(s1)-c1cncc(N)c1 |r|

BDBM50543323

C[C@@H](NC(N)=N)C(=O)Nc1nc(cs1)C(C)=O |r|

BDBM50514861

C[C@@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl |r|

BDBM50514863

C[C@@H]1CN(C[C@H]1C)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl |r|

BDBM50514871

C[C@@H]1CN(C[C@H]1C)S(=O)(=O)c1cc(NC(=O)CN2C(=O)NC(C)(C3CC3)C2=O)ccc1Br |r|

BDBM50558065

C[C@@H]1CN(c2ccc(Cl)cc2)c2cc(ccc2-n2c(C)nnc12)-c1ccc(N)nc1 |r|

BDBM50514895

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl |r|

BDBM50514857

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)ccc1Br |r|

BDBM50514885

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)ccc1Br |r|

BDBM50514851

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cc2coc3ccccc23)ccc1Br |r|

BDBM50514852

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cc2noc3ccccc23)ccc1Br |r|

BDBM50514872

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2c3ccccc3[nH]c2=O)ccc1Br |r|

BDBM50514873

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2c3ccccc3oc2=O)ccc1Br |r|

BDBM50514875

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2cc(CN(C)C)nn2)ccc1Br |r|

BDBM50514849

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2ccnn2)ccc1Br |r|

BDBM50514887

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2nnc(C)c2C)ccc1Br |r|

BDBM50514889

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2nnc3CCN(C)Cc23)ccc1Br |r|

BDBM50514877

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2nnc3CN(C)CCc23)ccc1Br |r|

BDBM50514890

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2nnc3CN(CC(F)(F)F)CCc23)ccc1Br |r|

BDBM50514879

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2nnc3CN(CCc23)C(C)=O)ccc1Br |r|

BDBM50514897

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2nnc3CNCCc23)ccc1Br |r|

BDBM50514886

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2nnc3ccccc23)ccc1Br |r|

BDBM50514894

C[C@H]1CCN(C1)S(=O)(=O)c1cc(NC(=O)Cn2nncc2CN(C)C)ccc1Br |r|

BDBM50514880

C[C@H]1CN(C[C@H]1C)S(=O)(=O)c1cc(NC(=O)CN2C(=O)CNC2=O)ccc1Cl |r|

BDBM50098306

C[C@H]1C[C@@H](CO[C@@H]2CNCC[C@H]2Nc2ncc(-c3cncc(C)c3)c3cc(C)c(=O)[nH]c23)C[C@@H](C)S1(=O)=O |r|

BDBM50028142

C[C@H]1C[C@@H](Nc2ccc(Cl)cc2)c2cc(ccc2N1C(C)=O)-c1ccc(cc1)C(O)=O |r|

BDBM50514870

C[C@]1(NC(=O)N(CC(=O)Nc2ccc(Br)c(c2)S(=O)(=O)N2CCCC2)C1=O)C1CC1 |r|

BDBM50504151

Cc1[nH]c(=O)c(C#N)c(C)c1CCC(=O)Nc1ccc(Cl)c(c1)S(=O)(=O)N1CCCCC1

BDBM50572129

Cc1cc2c(cnc(NC3CCN(CCCN)CC3)c2[nH]c1=O)-c1cncc(CO)c1

BDBM50572127

Cc1cc2c(cnc(NC3CCN(CCCN)CC3)c2[nH]c1=O)C1=CCOCC1 |t:26|

BDBM50572125

Cc1cc2c(cnc(NC3CCN(CCCN)CC3)c2[nH]c1=O)C1CCCCC1

BDBM50572126

Cc1cc2c(cnc(NC3CCN(CCCN)CC3)c2[nH]c1=O)C1CCOCC1

BDBM50096313

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cc[nH]n1

BDBM50096320

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cccc(O)c1

BDBM50096314

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cccc2[nH]ncc12

BDBM50096318

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1ccccc1

BDBM50096322

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1ccccn1

BDBM50096312

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cccnc1

BDBM50096316

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cccnc1C

BDBM50096315

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1ccncc1

BDBM50096317

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cn[nH]c1

BDBM50096308

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cncc(COC(N)=O)c1

BDBM50096283

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cncc(Cl)c1

BDBM50096280

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cncc(N)c1

BDBM50096281

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cncc(NS(C)(=O)=O)c1

BDBM50096296

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cncc(c1)C(N)=O

BDBM50096307

Cc1cc2c(cnc(NC3CCNCC3)c2[nH]c1=O)-c1cncnc1

BDBM50098251

Cc1cc2c(cnc(N[C@@H]3CCNC[C@H]3OCC3CCCCC3)c2[nH]c1=O)-c1cncc(N)c1 |r|

BDBM50098254

Cc1cc2c(cnc(N[C@@H]3CCNC[C@H]3OCC3CCOCC3)c2[nH]c1=O)-c1cccnc1 |r|

BDBM50098304

Cc1cc2c(cnc(N[C@@H]3CCNC[C@H]3OCC3CCOCC3)c2[nH]c1=O)-c1cncnc1 |r|

BDBM50098255

Cc1cc2c(cnc(N[C@@H]3CCNC[C@H]3OCC3CCS(=O)(=O)CC3)c2[nH]c1=O)-c1cccnc1 |r|

BDBM50249810

Cc1cc2cc(NS(=O)(=O)c3ccc(cc3)C#N)ccc2n(C)c1=O

BDBM50093446

Cc1cc2cccc(NC3CCNCC3)c2[nH]c1=O

BDBM50093468

Cc1cc2cccc(NCCC(O)=O)c2[nH]c1=O

BDBM50093465

Cc1cc2cccc(NCCCO)c2[nH]c1=O

BDBM50093464

Cc1cc2cccc(NCCO)c2[nH]c1=O

BDBM50093466

Cc1cc2cccc(NCc3ncc[nH]3)c2[nH]c1=O

BDBM50093448

Cc1cc2cccc(N[C@@H]3CCNC3)c2[nH]c1=O |r|

BDBM50093450

Cc1cc2cccc(N[C@H]3CCNC3)c2[nH]c1=O |r|

BDBM50096297

Cc1cc2ccccc2[nH]c1=O

BDBM50093461

Cc1cc2ccnc(NC3CCN(CC3)C3CC3)c2[nH]c1=O

BDBM50093447

Cc1cc2ccnc(NC3CCNCC3)c2[nH]c1=O

BDBM50093459

Cc1cc2ccnc(NCC3CCCNC3)c2[nH]c1=O

BDBM50093454

Cc1cc2ccnc(NCC3CCNCC3)c2[nH]c1=O

BDBM50093453

Cc1cc2ccnc(NCCC3CCCNC3)c2[nH]c1=O

BDBM50093452

Cc1cc2ccnc(NCCC3CCNCC3)c2[nH]c1=O

BDBM50093458

Cc1cc2ccnc(NC[C@H]3CCNC3)c2[nH]c1=O |r|

BDBM50093456

Cc1cc2ccnc(N[C@@H]3CCCNC3)c2[nH]c1=O |r|

BDBM50093449

Cc1cc2ccnc(N[C@@H]3CCNC3)c2[nH]c1=O |r|

BDBM50560176

Cc1cc2ccnc(N[C@@H]3CCNC[C@@H]3C(=O)NC3CCCCC3)c2[nH]c1=O |r|

BDBM50560179

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3C(=O)NC3CCCC3)c2[nH]c1=O |r|

BDBM50560175

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3C(=O)NC3CCCCC3)c2[nH]c1=O |r|

BDBM50560182

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3C(=O)NC3CCOCC3)c2[nH]c1=O |r|

BDBM50560180

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3C(=O)NCC3CC3)c2[nH]c1=O |r|

BDBM50560177

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3C(=O)NCC3CCCC3)c2[nH]c1=O |r|

BDBM50560183

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3C(=O)N[C@@H]3CCCOC3)c2[nH]c1=O |r|

BDBM50560184

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3C(=O)N[C@H]3CCCOC3)c2[nH]c1=O |r|

BDBM50098316

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OCC3CCCC3)c2[nH]c1=O |r|

BDBM50098249

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OCC3CCCCC3)c2[nH]c1=O |r|

BDBM50098317

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OCC3CCCCCC3)c2[nH]c1=O |r|

BDBM50098252

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OCC3CCOCC3)c2[nH]c1=O |r|

BDBM50098253

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OCC3CCS(=O)(=O)CC3)c2[nH]c1=O |r|

BDBM50098310

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OCCC3CCOCC3)c2[nH]c1=O |r|

BDBM50098309

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OC[C@@H]3CCS(=O)(=O)C3)c2[nH]c1=O |r|

BDBM50098329

Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OC[C@H]3CC[C@H](O)CC3)c2[nH]c1=O |r,wU:14.15,17.17,wD:9.8,20.21,(-3.75,1.39,;-2.68,.77,;-1.33,1.54,;,.77,;1.33,1.54,;2.66,.77,;2.66,-.77,;1.33,-1.54,;1.33,-3.08,;2.67,-3.85,;4,-3.07,;5.34,-3.84,;5.34,-5.38,;4.01,-6.15,;2.68,-5.39,;1.34,-6.16,;.01,-5.39,;-1.33,-6.16,;-1.32,-7.7,;-2.65,-8.48,;-3.99,-7.71,;-5.05,-8.33,;-4,-6.17,;-2.66,-5.4,;,-.77,;-1.33,-1.54,;-2.68,-.77,;-3.75,-1.39,)|

BDBM50093457

Cc1cc2ccnc(N[C@H]3CCC[C@H](N)C3)c2[nH]c1=O |r|

BDBM50093451

Cc1cc2ccnc(N[C@H]3CCNC3)c2[nH]c1=O |r|

BDBM50098318

Cc1cc2ccnc(N[C@H]3CCNC[C@@H]3OCC3CCCCC3)c2[nH]c1=O |r|

BDBM50098330

Cc1cc2ccnc(N[C@H]3CCNC[C@@H]3OCC3CCOCC3)c2[nH]c1=O |r|

BDBM50098308

Cc1cc2ccnc(N[C@H]3CCNC[C@@H]3OCC3CCS(=O)(=O)CC3)c2[nH]c1=O |r|

BDBM50030938

Cc1cc2n(C)c(=O)n(C)c2cc1N

BDBM50030939

Cc1cc2ncccc2nc1O

BDBM50504167

Cc1ccc(NC(=O)CN2C(=O)NC(C)(C)C2=O)cc1S(=O)(=O)N1CCCCCC1

BDBM50504143

Cc1ccc(NC(=O)CN2C(=O)NC(C)(C3CC3)C2=O)cc1S(=O)(=O)N1CCCCC1

BDBM50504157

Cc1ccc(NC(=O)CN2C(=O)NC(Cc3ccccc3)C2=O)cc1S(=O)(=O)N1CCCCC1

BDBM50504156

Cc1ccc(NC(=O)CN2C(=O)NC3(CCc4ccccc34)C2=O)cc1S(=O)(=O)N1CCCCC1

BDBM50504152

Cc1ccc(cc1)C1(C)NC(=O)N(CC(=O)Nc2ccc(C)c(c2)S(=O)(=O)N2CCCCC2)C1=O

BDBM50096299

Cc1ccc(cn1)-c1cnc(NC2CCNCC2)c2[nH]c(=O)c(C)cc12

BDBM50572124

Cc1cccc(c1)-c1cnc(NC2CCN(CCCN)CC2)c2[nH]c(=O)c(C)cc12

BDBM50504145

Cc1ccccc1C(=O)NCC(=O)Nc1ccc(C)c(c1)S(=O)(=O)N1CCCCCC1

BDBM50096301

Cc1ccncc1-c1cnc(NC2CCNCC2)c2[nH]c(=O)c(C)cc12

BDBM50464129

Cc1cncc(c1)-c1ccc(N[C@@H]2CCNC[C@H]2OCC2CCC(F)(F)CC2)c2[nH]c(=O)c(C)cc12 |r|

BDBM50098305

Cc1cncc(c1)-c1ccc(N[C@@H]2CCNC[C@H]2OCC2CCS(=O)(=O)CC2)c2[nH]c(=O)c(C)cc12 |r|

BDBM50572123

Cc1cncc(c1)-c1cnc(NC2CCN(CCCN)CC2)c2[nH]c(=O)c(C)cc12

BDBM50572122

Cc1cncc(c1)-c1cnc(NC2CCN(CCN)CC2)c2[nH]c(=O)c(C)cc12

BDBM50572121

Cc1cncc(c1)-c1cnc(NC2CCN(CCO)CC2)c2[nH]c(=O)c(C)cc12

BDBM50096300

Cc1cncc(c1)-c1cnc(NC2CCNCC2)c2[nH]c(=O)c(C)cc12

BDBM50098250

Cc1cncc(c1)-c1cnc(N[C@@H]2CCNC[C@H]2OCC2CCCCC2)c2[nH]c(=O)c(C)cc12 |r|

BDBM50098300

Cc1cncc(c1)-c1cnc(N[C@@H]2CCNC[C@H]2OCC2CCOCC2)c2[nH]c(=O)c(C)cc12 |r|

BDBM50098301

Cc1cncc(c1)-c1cnc(N[C@@H]2CCNC[C@H]2OCC2CCS(=O)(=O)CC2)c2[nH]c(=O)c(C)cc12 |r|

BDBM50098319

Cc1cncc(c1)-c1cnc(N[C@H]2CCNC[C@@H]2OCC2CCCCC2)c2[nH]c(=O)c(C)cc12 |r|

BDBM50096298

Cc1cncc(c1C)-c1cnc(NC2CCNCC2)c2[nH]c(=O)c(C)cc12

BDBM50468909

Cc1nc(NC(=O)CCCOc2ccc(C)cc2)sc1C

BDBM50365264

Cc1nnc2[C@H](NC(=O)OCc3ccccc3)N=C(c3ccccc3)c3ccccc3-n12 |r,t:18|

BDBM249277

Cc1noc(C)c1-c1cc(-c2c(C)ccc3ncccc23)c2[nH]c(nc2c1)C1CC1 |(1.89,3.57,;.56,4.34,;.08,5.8,;-1.46,5.8,;-1.94,4.34,;-3.27,3.57,;-.69,3.44,;-.69,1.9,;.64,1.13,;.64,-.41,;1.98,-1.18,;3.31,-.41,;3.31,1.13,;4.65,-1.18,;4.65,-2.72,;3.31,-3.49,;3.31,-5.03,;1.98,-5.8,;.64,-5.03,;.64,-3.49,;1.98,-2.72,;-.69,-1.18,;-1.01,-2.69,;-2.54,-2.85,;-3.17,-1.45,;-2.02,-.41,;-2.02,1.13,;-3.31,-4.19,;-4.65,-4.96,;-3.31,-5.73,)|

BDBM50504155

Clc1ccc(NC(=O)CCNC(=O)c2ccccc2)cc1S(=O)(=O)N1CCCCC1

BDBM50504162

Clc1ccc(NC(=O)CCNC2=NS(=O)(=O)c3ccccc23)cc1S(=O)(=O)N1CCCC1 |t:11|

BDBM50514868

Clc1ccc(NC(=O)CN2C(=O)CCC2=O)cc1S(=O)(=O)N1CCCC1

BDBM50514848

Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)C1CCCCC1

BDBM50514864

Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)N1CCC(C1)C1CC1

BDBM50514862

Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)N1CCC2(CC2)C1

BDBM50514898

Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)N1CCCCC1

BDBM50514859

Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)N1CCCCCC1

BDBM50514865

Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)n1ccnc1

BDBM50514867

Clc1ccc(NC(=O)CN2C(=O)COC2=O)cc1S(=O)(=O)N1CCCC1

BDBM50504140

Clc1ccc(NC(=O)CN2C(=O)NC(CCc3ccccc3)C2=O)cc1S(=O)(=O)N1CCCCC1

BDBM50514884

Clc1ccc(NC(=O)CN2CCCC2=O)cc1S(=O)(=O)N1CCCC1

BDBM50504139

Clc1ccc(NC(=O)CNC(=O)C2CCCCC2)cc1S(=O)(=O)N1CCCCC1

BDBM50157646

Cn1c2ccccc2ccc1=O

BDBM50030967

NC1=NC2=C(CCCC2)C2(CCCCC2)S1 |t:1,3|

BDBM50030941

Nc1ccc2CCCN(C(=O)C3CC3)c2c1

BDBM50030942

Nc1cccc(c1)-c1n[nH]c(n1)-c1ccccc1

BDBM50030958

Nc1cccc(c1)-c1nnc(o1)-c1cccs1

BDBM50030959

Nc1ccccc1-c1nnc(o1)-c1ccncc1

BDBM50096311

[H][C@]12CC[C@]([H])(C[C@@H](C1)Nc1nccc3cc(C)c(=O)[nH]c13)N2C |r|

BDBM50096319

[H][C@]12CC[C@]([H])(C[C@H](C1)Nc1nccc3cc(C)c(=O)[nH]c13)N2C |r|

BDBM50464134

[H][C@]12CC[C@]([H])(N1)[C@@H](CCC1CCC(F)(F)CC1)[C@@H](C2)Nc1ncc(-c2cncc(C)c2)c2cc(C)c(=O)[nH]c12 |r|

BDBM50464131

[H][C@]12CC[C@]([H])(N1)[C@@H](CCC1CCOCC1)[C@@H](C2)Nc1ncc(-c2cncc(C)c2)c2cc(C)c(=O)[nH]c12 |r|

BDBM50464135

[H][C@]12CC[C@]([H])(N1)[C@@H](CCC1CCS(=O)(=O)CC1)[C@@H](C2)Nc1ccc(-c2cncc(C)c2)c2cc(C)c(=O)[nH]c12 |r|

BDBM50464132

[H][C@]12CC[C@]([H])(N1)[C@@H](CCC1CCS(=O)(=O)CC1)[C@@H](C2)Nc1ncc(-c2cncc(C)c2)c2cc(C)c(=O)[nH]c12 |r|

BDBM50584934

[H][C@]12Cc3ccccc3[C@]([H])(CN(C)C1=O)N2C(=O)c1cn(C)c(=O)c2[nH]ccc12 |r,THB:17:16:11.12.14:3.8.2|

BDBM50584928

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1c[nH]c(=O)c(C)c1 |r,THB:16:15:3.8.2:13.12.11|

BDBM50584929

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(N)c(=O)n(C)c1 |r,THB:16:15:3.8.2:13.12.11|

BDBM50584933

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(N)c2nnc(C)n2c1 |THB:16:15:11.12.13:3.8.2|

BDBM50584939

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(N)c2nnc(C)n2n1 |r,THB:16:15:11.12.13:3.8.2|

BDBM50584930

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(NC)c(=O)n(C)c1 |THB:16:15:11.12.13:3.8.2|

BDBM50584940

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(NC2CCN(C)CC2)c2nnc(C)n2c1 |r,THB:16:15:11.12.13:3.8.2|

BDBM50584941

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(NC2CCN(C)CC2)c2nnc(C)n2n1 |r,THB:16:15:11.12.13:3.8.2|

BDBM50584943

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(NCCCN2CCCC2)c2nnc(C)n2n1 |r,THB:16:15:11.12.13:3.8.2|

BDBM50584927

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(OC)c(O)c(OC)c1 |r,THB:16:15:3.8.2:13.12.11|

BDBM50584932

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cc(OC)c2[nH]nc(C)c2c1 |r,THB:16:15:11.12.13:3.8.2|

BDBM50584935

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cn(C)c(=O)c2[nH]c3ccccc3c12 |r,THB:16:15:11.12.13:3.8.2|

BDBM50584931

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cn(C)c(=O)c2[nH]ccc12 |r,THB:16:15:11.12.13:3.8.2|

BDBM50584942

[H][C@]12Cc3ccccc3[C@]([H])(CNC1=O)N2C(=O)c1cn2c(C)nnc2c(NC2CCN(C)CC2)n1 |r,THB:16:15:11.12.13:3.8.2|

BDBM50584938

[H][C@]12Cc3ccccc3[C@]([H])([C@@H](C)NC1=O)N2C(=O)c1cn(C)c(=O)c2[nH]c3ccc(OC(F)(F)F)cc3c12 |r,THB:17:16:11.13.14:3.8.2|

BDBM50584936

[H][C@]12Cc3ccccc3[C@]([H])([C@@H](C)NC1=O)N2C(=O)c1cn(C)c(=O)c2[nH]c3ccccc3c12 |r,THB:17:16:11.13.14:3.8.2|

BDBM50584925

[H][C@]12Cc3ccccc3[C@]([H])([C@H](NC1=O)C(C)C)N2C(=O)c1cc(NC2CCN(CC(C)(C)F)CC2)c2nnc(C)n2n1 |r,THB:19:18:3.8.2:13.12.11|

BDBM50584946

[H][C@]12Cc3ccccc3[C@]([H])([C@H](NC1=O)C(C)C)N2C(=O)c1cc(NC2CCN(CC(C)(F)F)CC2)c2nnc(C)n2n1 |r,THB:19:18:11.12.13:3.8.2|

BDBM50584945

[H][C@]12Cc3ccccc3[C@]([H])([C@H](NC1=O)C(C)C)N2C(=O)c1cc(NCCCN2CCC(F)(F)CC2)c2nnc(C)n2n1 |r,THB:19:18:11.12.13:3.8.2|

BDBM50584944

[H][C@]12Cc3ccccc3[C@]([H])([C@H](NC1=O)C(C)C)N2C(=O)c1cc(NCCCN2CCCC2)c2nnc(C)n2n1 |r,THB:19:18:11.12.13:3.8.2|

BDBM50584937

[H][C@]12Cc3ccccc3[C@]([H])([C@H](NC1=O)C(C)C)N2C(=O)c1cn(C)c(=O)c2[nH]c3ccccc3c12 |r,THB:19:18:11.12.13:3.8.2|

BDBM50030951

c1ccc(cc1)-c1nnc(o1)-c1ccncc1