SMILES for Disintegrin and metalloproteinase domain-containing protein 10

Cc1ccc(cc1)C1C(C=C2SC(S)=NC2=O)=C(Oc2ccccc12)c1cccs1 |w:9.9,c:14,18,(11.05,-6.19,;11.05,-4.65,;9.72,-3.88,;9.72,-2.34,;11.05,-1.57,;12.38,-2.34,;12.38,-3.88,;11.05,-.03,;9.72,.74,;8.38,-.03,;7.05,.74,;5.64,.11,;4.61,1.26,;3.08,1.1,;5.38,2.59,;6.89,2.27,;8.03,3.3,;9.72,2.28,;11.05,3.05,;12.38,2.28,;13.76,3.1,;15.16,2.31,;15.16,.71,;13.76,-.08,;12.38,.74,;9.72,3.82,;10.96,4.73,;10.49,6.19,;8.95,6.19,;8.47,4.73,)|

BDBM50102

CN(C)c1ccc(NC(=O)c2cn(nc2-c2cccs2)-c2ccccc2)cc1

BDBM48499

Cc1cc(NC(=O)c2c(F)cccc2Cl)n(n1)-c1nc2ccccc2[nH]1

BDBM113840

CCc1ccc(\C=c2/s\c(=C/C(=O)C(C)(C)C)[nH]c2=O)cc1

BDBM113841

CCCCn1c(SCc2nc(N)nc(Nc3ccccc3C)n2)nc2ccccc2c1=O

BDBM113842

Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)c3ccc(Br)o3)cc2)c1

BDBM113843

Cc1cccc(OCC(=O)NNC(=O)c2cc3ccccc3oc2=O)c1

BDBM96310

COc1cc(\C=N\NC(=O)COc2ccc(Cl)cc2)ccc1OS(=O)(=O)c1ccc(C)cc1

BDBM52356

O=C(Cn1cncn1)NN=Cc1c2ccccc2cc2ccccc12 |w:9.9|

BDBM113844

CCOc1ccc(\C=N\NC(=O)Cc2csc(Nc3cccc(c3)C(F)(F)F)n2)c(OCC)c1

BDBM113845

Clc1ccc(cc1)C1N(CCc2c1[nH]c1ccccc21)C(=O)c1cccs1

BDBM113846

Oc1cc(N(CCc2ccccc2)C(=S)Nc2cc(Cl)ccc2Cl)c(O)n1-c1c(Cl)cccc1Cl |(3.08,-2.51,;4.54,-2.03,;5.02,-.56,;6.56,-.56,;7.47,.68,;9,.52,;9.9,1.77,;11.43,1.61,;12.06,.2,;13.59,.04,;14.5,1.28,;13.87,2.69,;12.34,2.85,;6.84,2.09,;5.31,2.25,;7.74,3.33,;7.12,4.74,;5.59,4.9,;4.96,6.31,;3.43,6.47,;5.87,7.55,;7.4,7.39,;8.02,5.99,;9.55,5.83,;7.04,-2.03,;8.5,-2.51,;5.79,-2.93,;5.79,-4.47,;4.46,-5.24,;3.12,-4.47,;4.46,-6.78,;5.79,-7.55,;7.12,-6.78,;7.12,-5.24,;8.46,-4.47,)|

BDBM113847

CC(Nc1ccccc1C)C(=O)N\N=C\c1ccccc1OCc1cccc(Br)c1

BDBM113848

Clc1ccc(SCC(=O)N2CCC(CC2)c2nc3ccccc3s2)c(Cl)c1

BDBM52400

C\C(\C=C1/N=C(SCc2ccccc2Cl)SC1=O)=C/c1ccccc1 |t:4|

BDBM52404

CCCNc1c(F)c(F)c2c(C)c3ccccc3nc2c1F

BDBM52424

Cc1nnc(=O)[nH]c1N=[NH+]C[c-]1ccc(=O)c(c1)[N+]([O-])=O |w:8.8|

BDBM72073

O=C(Nc1c(C#N)c(c(-c2ccccc2)n1Cc1ccco1)-c1ccccc1)c1cccs1

BDBM113849

Cc1ccc(cc1)C(=S)NCS(=O)(=O)c1ccc(C)cc1

BDBM52442

CCOC(=O)Cc1csc(NC(=O)c2sc3nc4cc(C)ccc4cc3c2N)n1

BDBM113850

Cc1ccc(Nc2nc(N)nc(CSc3nc4ccccc4s3)n2)cc1

BDBM77405

Cc1cccc2cc(CN(Cc3ccco3)C(=O)Nc3cccc(c3)C#N)c(Cl)nc12

BDBM113851

COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)c1cc(n[nH]1)-c1cccc2ccccc12

BDBM113852

Cc1cc(C)cc(NS(=O)(=O)c2ccc(Oc3ncc(cc3Cl)C(F)(F)F)cc2)c1

BDBM113853

Cc1ccc(cc1)S(=O)(=O)N1CCC(=O)N1

BDBM113854

C(C=CN=Nc1nc2ccccc2s1)c1ccccc1 |w:4.4,1.0|

BDBM113855

C\C(\C=C1/SC(=O)N(CC(=O)Nc2cccc(O)c2)C1=O)=C/c1ccccc1

BDBM113856

NS(=O)(=O)c1ccc(NCc2cc(Cl)ccc2OCc2ccccc2F)cc1

BDBM52520

CSc1nsc2nc(=O)c(\C=C3/C=Nc4ccccc34)c(N)n12 |c:12|

BDBM113857

[H]C12CC3([H])CC([H])(C1)CC(C2)(C3)c1ccc(cc1)N(CC(=O)Nc1ccccc1OC)S(C)(=O)=O |TLB:5:3:11:6.9.8,THB:5:6:11:3.12.2,2:3:9:1.11.8|

BDBM52525

COc1ccc(C=CC(=O)c2c(O)n(CCC3=CCCCC3)c(=O)[nH]c2=O)cc1OC |w:7.7,t:16|

BDBM113858

COc1cc(CN=O)cc(Br)c1OCc1ccc(Cl)cc1

BDBM113859

COc1ccc(NC(=S)Nc2cc(n[nH]2)-c2ccccc2)cc1Cl

BDBM113860

Cc1cccc(NS(=O)(=O)c2cc(ccc2C)C(=O)Nc2ccccc2-c2ccccc2)c1C

BDBM113861

COc1ccc(cc1)N(CC(O)Cn1c2ccccc2c2ccccc12)S(=O)(=O)c1ccccc1

BDBM113862

CSc1cccc(NC(=O)\C=C\c2ccc(Cl)cc2)c1

BDBM52558

Cc1cc(\C=C(\C#N)c2nc3ccccc3[nH]2)c(C)n1-c1ccccc1C(O)=O |(6.38,-1.44,;7.79,-.82,;8.11,.69,;9.64,.85,;10.41,2.18,;9.64,3.52,;10.41,4.85,;11.18,6.18,;8.1,3.52,;7.2,2.28,;5.75,2.75,;4.41,1.98,;3.08,2.75,;3.08,4.29,;4.41,5.06,;5.75,4.29,;7.2,4.76,;10.27,-.56,;11.78,-.88,;9.13,-1.59,;9.29,-3.12,;8.04,-4.03,;8.2,-5.56,;9.61,-6.18,;10.85,-5.28,;10.69,-3.75,;12.23,-3.85,;12.9,-5.24,;13.09,-2.58,)|

BDBM52570

Cc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(F)cc2)c(C)n1-c1cccc(c1)C(O)=O |w:4.3|

BDBM113863

Clc1nc(N=NCc2ccccc2)c(Cl)c(Cl)c1C#N |w:4.3|

BDBM113864

O=C(CN(Cc1cccs1)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NC1CCCCC1)Nc1ccccc1

BDBM84075

COc1ccccc1NC(=S)NN=Cc1c[nH]c2ccc(cc12)S(=O)(=O)N1CCCCC1 |w:12.12|

BDBM70704

Cc1ccc(cc1)C(=O)C1C(C2CSCN2[C@@]11C(=O)Nc2ccc(C)cc12)c1cccc(c1)[N+]([O-])=O

BDBM44650

NC(=O)C1CCN(CC1)C(=O)c1ccc2c3nc4ccccc4n3c(SCC#N)nc2c1

BDBM113865

Cc1cccc(OCCNC(=O)c2cccc(Oc3ccc(cc3[N+]([O-])=O)C(F)(F)F)c2)c1

BDBM67995

OC(COCC(F)(F)C(F)(F)C(F)(F)C(F)F)Cn1c2ccccc2c2ccccc12

BDBM65162

Nc1nc(c(N=Nc2ccccc2Cl)s1)-c1ccccc1 |w:6.6|

BDBM113866

O=C(NCC1CCCO1)C(N(Cc1ccccc1)C(=O)c1ccc([nH]1)-c1ccccc1)c1cccs1

BDBM113867

Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nnc(SCc2ccccc2Cl)o1

BDBM113868

CCC(=O)N(Cc1ccco1)c1nc(C(=O)Nc2ccc(Cl)cc2)c(C)s1

BDBM70772

CCOC(=O)c1ccc(cc1)N1C(c2c(n[nH]c2C1=O)-c1ccco1)c1ccc(cc1)[N+]([O-])=O

BDBM68014

Clc1ccc(NC(CNS(=O)(=O)c2ccc(Cl)cc2)c2ccccc2)cc1

BDBM113869

Clc1ccc(NC(CNS(=O)(=O)c2ccccc2)c2ccccc2)cc1

BDBM113870

COc1ccc(NC(C)C(=O)N\N=C\c2ccccc2OCc2cccc(Br)c2)cc1

BDBM72230

Fc1ccc(cc1C(=O)Nc1cccc(Cl)c1)S(=O)(=O)NCCc1ccc(Cl)cc1

BDBM113871

CNC(=S)NN=Cc1cn(CCOc2ccc(OC)cc2)c2ccccc12 |w:5.4|

BDBM113872

CCCOc1ccc(NC(=O)CC2N(Cc3cccs3)C(=S)N(Cc3ccccc3)C2=O)cc1

BDBM113873

Clc1ccc(C(=O)N\C(=C/c2ccc3OCOc3c2)C(=O)NCCc2nc3ccccc3[nH]2)c(Cl)c1

BDBM113874

Oc1ccc(cc1)C1CC(=NN1C(=O)c1cccs1)c1ccccc1 |c:10|

BDBM113875

Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1csc(n1)-c1ccccc1

BDBM52699

Cc1ccc(NCC(=O)NN=Cc2ccc(cc2)C(O)=O)cc1

BDBM113876

CSc1cccc(NC(=O)CCCOc2ccc(Cl)cc2C)c1

BDBM113877

Clc1ccccc1C(=O)N\N=C\c1cn(nc1-c1ccccc1)-c1cccs1

BDBM113878

COc1cc(OC)c(cc1Cl)N(C)S(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1c[nH]c2ccccc12

BDBM68039

CN(C)c1ccc(cc1)C(CNS(=O)(=O)c1ccc(F)c(F)c1)c1c[nH]c2ccccc12

BDBM52725

Clc1ccc(cc1)-n1nc2c(cc1=O)[nH][nH]c2=O

BDBM65996

[O-][N+](=O)c1ccc(=O)[c-](C[NH+]=Nc2ccccn2)c1 |w:10.9|

BDBM113879

CC(=O)c1cccc(NC(=O)C(OC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c2ccccc2)c1

BDBM113880

COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)Nc3ccc(cc3)C(C)=O)c2c1

BDBM80182

CCN(CC)c1ccc(NC(=O)COc2ccccc2C)cc1S(=O)(=O)Nc1ccccc1OC

BDBM68053

COc1ccccc1NC(=O)c1c(N)c(sc1Nc1ccccc1C)C(=O)Nc1cccc(Cl)c1

BDBM54807

COCCN=c1scc(-c2cc(OC)ccc2OC)n1N=Cc1c[nH]c2ccccc12 |w:20.21,4.3|

BDBM88885

COCCN=c1scc(-c2cc(OC)c(OC)c(OC)c2)n1N=Cc1c(C)[nH]c2ccccc12 |w:22.23,4.3|

BDBM113881

O=C(COC(=O)CCCSc1nc2ccccc2[nH]1)Nc1ccc(Oc2ccccc2)cc1

BDBM52782

COc1ccc(cc1)N=C(C)c1sc2ccccc2c1O |w:8.8|

BDBM72299

Cc1ccccc1\N=C1/SC(CC(=O)Nc2ccc3ccccc3c2)C(=O)N1Cc1ccccn1

BDBM113882

FC(F)(F)Oc1ccc(NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)c2cccs2)cc1

BDBM72302

Cc1ccc(N(CC(=O)NCCc2ccc(F)cc2)S(=O)(=O)c2ccc(Cl)c(c2)[N+]([O-])=O)c(C)c1

BDBM113883

Cc1ccc(NC(=O)c2cc3CCCCc3s2)cc1S(=O)(=O)Nc1ccccc1Cl

BDBM52791

COC(=O)c1ccc(cc1)-n1c(C)cc(CN=Nc2nc(C)cc(=O)[nH]2)c1C |w:16.16|

BDBM52793

[#6]-[#7]-1-[#6](=O)-[#7](-[#6])-[#6](=O)\[#6](=[#6]\[#7]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6](-[#8])=O)-[#6]-1=O

BDBM113884

Brc1cccc(c1)-c1csc(NC(=O)CSc2nc3ccccc3[nH]2)n1

BDBM113885

CCOC(=O)c1c(C)c(C)sc1NC(=O)CN1C(=O)NC(C)(C1=O)c1ccc(OC(F)F)cc1

BDBM113886

Brc1ccc(NC(=O)CC2S\C(=N/c3ccccc3)N(Cc3ccccn3)C2=O)cc1

BDBM113887

FC(F)(F)c1cccc(NC(=S)NCC2COc3ccccc3O2)c1

BDBM113888

Cc1ccc(cc1)-n1c(SCC(=O)Nc2cccc(c2)S(N)(=O)=O)nc2ccccc12

BDBM113889

COc1ccc(NC(=O)c2ccc(cc2)-c2ccccc2)cc1NS(=O)(=O)c1ccc(F)cc1

BDBM52809

Oc1c(C=NCCN2CCCCC2)c(=O)[nH]c(=O)n1-c1ccc(Br)cc1 |w:4.4|

BDBM113890

COc1cc(\C=N\OCC(=O)Nc2ccc(OC(F)F)cc2)ccc1OCc1ccccc1

BDBM64641

Cc1cc(C)c(cc1C)-c1cc(NC(=O)COC(=O)c2ccc(cc2)C#N)n(n1)-c1ccccc1

BDBM113891

COc1ccccc1N(CC=C)S(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1c[nH]c2ccccc12

BDBM113892

O=S(=O)(N1CCOCC1)c1ccc(NC(=S)NCCC(c2ccccc2)c2ccccc2)cc1

BDBM113893

Clc1ccc(cc1S(=O)(=O)N1CCCCCC1)C(=O)OCC(=O)Nc1ccccc1

BDBM52822

Cc1cccc(Oc2nc(nc3ccccc23)-c2ccccn2)c1

BDBM95734

COc1ccccc1NS(=O)(=O)c1cccc(NC(=O)Nc2cccc(Cl)c2)c1

BDBM113894

CN(C)c1ccc(cc1)C(CNS(=O)(=O)c1ccc(F)cc1)c1c[nH]c2ccccc12

BDBM52890

COC(=O)CCCC1=CC2=CC(=O)C(C)(OC(=O)C3CCCC3)C(=O)C2=CO1 |c:27,t:7,9|

BDBM79563

Cc1ccc(cc1)C(=O)Nc1nnc(NC(=S)Nc2ccccc2)s1

BDBM113895

CCc1ccc(cc1)-c1cn(C2CCCCC2)c(=S)[nH]1

BDBM113896

S=C(NC1CCCCCC1)Nc1ccc(Nc2ccccc2)cc1

BDBM50308030

CCOc1ccc(cc1)C(Nc1cccnc1)c1cc(Cl)c2cccnc2c1O

BDBM113897

CCC1COC(=[NH+]1)C(=C(/Cl)[C-](Cl)Cl)\[N+]([O-])=O |c:5|

BDBM48862

Oc1cc2OCOc2cc1C(N1CCCC1)c1ccc(Cl)c(Cl)c1

BDBM113898

CC(C)C[C@H](NC(=O)c1nc[nH]c1C(=O)NC(c1ccccc1)c1ccccc1)C(=O)OCc1ccccc1

BDBM95947

CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)c1nc[nH]c1C(=O)NC(c1ccccc1)c1ccccc1)C(=O)OC(C)(C)C

BDBM113899

Oc1cccc(\C=N\N(Cc2ccccc2)c2ccccc2)c1

BDBM68163

OC(CNCC(c1c[nH]c2ccccc12)c1ccc(Cl)cc1Cl)c1ccccc1

BDBM113900

OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)NCc2ccccc2)c2ccc(Br)cc2)cc1 |c:11|

BDBM113901

FC(F)(F)c1cc(CCN2[C@@H](Cc3ccccc3)CNC2=S)cc(c1)C(F)(F)F

BDBM53156

COc1ccc(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccc(Br)cc34)C2=O)c(OC)c1 |w:13.13|

BDBM53160

OC(=O)CCc1ccc(-c2ccccc2)n1-c1cccc(c1)C(O)=O

BDBM113902

COc1ccc(cc1OC)-c1c[nH]nc1-c1ccc(OCc2ccccc2)cc1O

BDBM113903

NC(=O)[C@@H]1CC2(CN1C(=O)c1ccc(Cl)cc1)CC(=NO2)c1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1 |c:20|

BDBM113904

NC(=O)[C@H]1CC2(CN1C(=O)CC(c1ccccc1)c1ccccc1)CC(=NO2)c1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1 |c:28|

BDBM113905

NC(=O)[C@H]1CC2(CN1C(=O)C(c1ccccc1)c1ccccc1)CC(=NO2)c1cccc(NC(=O)COc2ccc(Cl)cc2)c1 |c:27|

BDBM113906

NC(=O)[C@@H]1CC2(CN1C(=O)COc1ccc(Cl)cc1)CC(=NO2)c1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1 |c:22|

BDBM113907

COc1ccc2nc(SCC(=O)Nc3ccc(cc3)S(=O)(=O)N3CCCC3)c(cc2c1)C#N

BDBM113908

O=C(CCn1cnc2ccccc2c1=O)Nc1oc(c(c1C#N)-c1ccccc1)-c1ccccc1

BDBM113909

ClCCc1ccc(cc1)S(=O)(=O)NNC(=O)C(=O)NNc1ccccc1

BDBM113910

CC(C)C[C@H](NC(=O)c1nc[nH]c1C(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1)C(=O)OC(C)(C)C

BDBM53413

Cc1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc1

BDBM113911

Cc1cccc(c1)[C@@H]1[C@H]2[C@H](C(=O)N(Cc3ccccc3)C2=O)[C@@]2(Cc3ccccc3)N1C(=O)N(C2=O)c1ccc(cc1)C(F)(F)F

BDBM64019

CC(C)(C)c1ccc(cc1)-c1cc(n[nH]1)-c1ccccc1O

BDBM59544

CCOc1ccc(NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1

BDBM113912

COc1ccccc1Nc1ccc(NC(=O)c2cccc(c2C)[N+]([O-])=O)cc1

BDBM113913

CC(C)(C)OC(=O)NCc1ccc(CNC(=O)c2nc[nH]c2C(=O)N[C@@H](Cc2ccccc2)C(=O)OC(C)(C)C)cc1

BDBM113914

COc1cccc(c1)C(=O)NNC(=O)C(=O)Nc1ccc(C)c(Cl)c1

BDBM113915

Cc1ccc(C)c(c1)S(=O)(=O)N1CCC(CC1)c1nc2n(Cc3ccc4OCCOc4c3)nnc2c(=O)[nH]1

BDBM53851

COc1ccc(cc1)-c1nnc(SCC(=O)Nc2cc(ccc2Cl)S(=O)(=O)N2CCCCC2)n1N

BDBM113916

COc1ccc(cc1)C(=O)N\N=C\c1ccc(OC)c(COc2ccccc2)c1

BDBM113917

CC(C)c1c(nnn1-c1nonc1N)C(=O)N\N=C\c1cccc2ccccc12

BDBM113918

COc1ccc(C)c2sc(nc12)N(CCCN(C)C)C(=O)c1ccc(cc1)S(=O)(=O)N1CCc2ccccc2C1

BDBM53537

COc1ccc(-c2n[nH]c(c2-c2cc3ccccc3o2)C(F)(F)F)c(O)c1

BDBM42818

O=C(C1CCC(Cn2c(=S)[nH]c3ccccc3c2=O)CC1)N1CCN(CC1)c1ccccc1 |(11.08,3.47,;11.08,1.93,;12.42,1.16,;13.75,1.93,;15.08,1.16,;15.08,-.39,;16.42,-1.16,;17.75,-.39,;17.75,1.16,;16.42,1.93,;19.08,1.93,;20.42,1.16,;21.8,1.98,;23.19,1.19,;23.19,-.42,;21.8,-1.21,;20.42,-.39,;19.08,-1.16,;19.08,-2.7,;13.75,-1.16,;12.42,-.39,;9.75,1.16,;8.41,1.93,;7.08,1.16,;7.08,-.39,;8.41,-1.16,;9.75,-.39,;5.75,-1.16,;4.41,-.39,;3.08,-1.16,;3.08,-2.7,;4.41,-3.47,;5.75,-2.7,)|

BDBM54124

O=C1N(NS(=O)(=O)c2ccccc2)C(=S)S\C1=C/c1cccs1

BDBM113919

COC(=O)c1ccc(cc1)-c1cc2onc(-c3ccccc3)c2c(=O)n1C

BDBM113920

[H][C@]12COc3ccccc3[C@]1([H])N1C(=O)c3ccc(C)cc3NC(=O)[C@@]1(C)[C@H]2c1ccccc1

BDBM113921

[H][C@]12COc3ccc(Cl)cc3[C@]1([H])N1C(=O)c3cc(OC)c(OC)cc3NC(=O)[C@@]1(C)[C@H]2c1ccccc1

BDBM76246

CCc1cc(Cn2nc(cc2C(=O)NCc2cccc(Br)c2)-c2ccccc2)on1

BDBM113922

COc1ccc(CN([C@H](CO)CC(C)C)S(=O)(=O)N(Cc2ccccc2)[C@H](CO)CC(C)C)cc1

BDBM113923

COC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)n1cc(nn1)-c1cc(cc(c1)-c1cn(nn1)[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC)C(=O)N1CCN(CC1)C(=O)OC(C)(C)C

BDBM113924

COC(=O)C1=C(C[C@@H]2CC[C@H]1N2C(=O)NCc1ccc(cc1)C(C)(C)C)c1ccccc1OCc1ccccc1 |t:4,TLB:2:4:11:8.9|

BDBM113925

CC1(C)Oc2ccc3C[C@H](COc3c2C=C1)c1ccc(O)cc1O |c:16|

BDBM113926

OCCN(Cc1ccccc1)C(=O)C[C@H](CC=C)C(=O)N[C@@H](COC(=O)[C@H](CCC=C)Cc1ccc(F)cc1)Cc1c[nH]c2ccccc12

BDBM113927

OCCN(Cc1ccccc1)C(=O)C[C@H](CC=C)C(=O)N[C@H](COC(=O)[C@@H](CC=C)Cc1ccc(F)cc1)Cc1c[nH]c2ccccc12

BDBM113928

OCCN(Cc1ccccc1)C(=O)C[C@@H](CC=C)C(=O)N[C@H](COC(=O)[C@@H](CCC=C)Cc1ccc(F)cc1)Cc1c[nH]c2ccccc12

BDBM113929

OCCN(Cc1ccccc1)C(=O)C[C@@H](CC=C)C(=O)NC[C@@H](OC(=O)[C@@H](CCC=C)Cc1ccc(F)cc1)c1ccccc1

BDBM113930

OCCN(Cc1ccccc1)C(=O)C[C@@H](CC=C)C(=O)N[C@H](COC(=O)[C@@H](CCC=C)Cc1ccc(F)cc1)c1ccccc1

BDBM113931

OCCN(Cc1ccccc1)C(=O)C[C@@H](CC=C)C(=O)N[C@H](COC(=O)[C@H](CCC=C)Cc1ccc(F)cc1)Cc1c[nH]c2ccccc12

BDBM113932

OCCN(Cc1ccccc1)C(=O)C[C@@H](CC=C)C(=O)N[C@@H](COC(=O)[C@H](CCC=C)Cc1ccc(F)cc1)Cc1c[nH]c2ccccc12

BDBM113933

OC[C@H](Cc1ccccc1)NC(=O)C[C@H](CC=C)C(=O)N[C@H](COC(=O)[C@H](CCC=C)Cc1ccc(F)cc1)Cc1c[nH]c2ccccc12

BDBM113934

OCCN(Cc1ccccc1)C(=O)C[C@@H](CC=C)C(=O)N[C@@H](COC(=O)[C@@H](CCC=C)Cc1ccc(F)cc1)Cc1c[nH]c2ccccc12

BDBM113935

C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2C1=O

BDBM113936

COc1ccccc1NS(=O)(=O)c1cc(NC(=O)c2cc(F)c(F)c(F)c2F)ccc1N1CCOCC1

BDBM113937

[O-][N+](=O)c1ccc(cc1)[C@@H]1[C-](N[N+](=C1C(=O)N1CCOC1=O)c1ccc(Br)cc1)c1ccc(F)cc1 |c:13|

BDBM113938

[O-][N+](=O)c1ccc(cc1)[C@@H]1[C-](N[N+](=C1C(=O)N1CCOC1=O)c1ccc(Br)cc1)c1cccc(Cl)c1 |c:13|

BDBM67733

COc1ccccc1Oc1c(C)[nH]nc1-c1ccc(OCC(C)=C)cc1O

BDBM51400

Cc1ccc(OCC(=O)Nc2nnc[nH]2)c(Br)c1

BDBM52179

CC(C)C1Nc2ccc(cc2C2C=CCC12)S(N)(=O)=O |c:13|

BDBM51399

O=C(CC1CCCCC1)Nc1nnc[nH]1

BDBM113939

CCN(CC)c1ccc(NC(=O)COC(=O)CSc2ccc(Br)cc2C)cc1

BDBM113940

CCn1nc(C(=O)OC(C(=O)c2c[nH]c3ccccc23)c2ccccc2)c2ccccc2c1=O

BDBM43128

Clc1cccc2c(Br)ccc(SCC(=O)Nc3ccc(cc3)S(=O)(=O)Nc3nccs3)c12

BDBM100259

Oc1c(ccccc1=O)C(=O)\C=C\c1ccc(cc1)[N+]([O-])=O

BDBM113941

CC(C)CC1N(Cc2ccc(cc2)-c2c(C)cccc2C)S(=O)(=O)CCN(Cc2cn(CCO)nn2)C1=O

BDBM113942

[H][C@@]12CN(C[C@]1(O)[C@H](Cn1n2c(=O)n(CCCCCC)c1=O)OC(=O)NCCCCCC)S(=O)(=O)c1ccc(C)cc1

BDBM113943

CC(C)C1N(Cc2ccc(cc2)-c2ccccc2)S(=O)(=O)CCN(Cc2cn(CC3CCCCC3)nn2)C1=O

BDBM83856

C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21

BDBM113944

C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O

BDBM113945

COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C(=O)N(C[C@H]1C)[C@H](C)CO

BDBM113946

CCCCCCn1c(=O)n2C[C@H](OC(=O)NCc3ccc(OC)c(OC)c3)[C@H](OC(=O)NCc3ccc(OC)c(OC)c3)[C@@H](CN(CC#C)S(=O)(=O)c3ccc(C)cc3)n2c1=O

BDBM113947

Cc1cc(C)c2c(c1)nc1C(Cc3ccc(O)cc3)NC(=O)c3cc4ccccc4cc3-n1c2=O

BDBM113948

CCOC(=O)C1=C(C)N(Cc2ccccc2)C(=O)NC1c1ccccc1OS(=O)(=O)c1ccccc1[N+]([O-])=O |c:5|

BDBM113949

CC(O)(c1nc(\C=C\c2ccccc2)cs1)c1cccc(F)c1

BDBM113950

OC(c1nc(cs1)-c1ccc(Cl)cc1)(c1ccccc1)C(F)(F)F

BDBM113951

COc1ccc(OC(F)(F)F)cc1CC1(C)C(=O)Nc2ccc(cc12)-c1ccsc1

BDBM113952

CC(O)(c1nc(cs1)-c1cccc(c1)C(F)(F)F)c1ccc(F)c(F)c1

BDBM113953

CC1(Cc2ccc(o2)C(F)(F)F)C(=O)Nc2cc(ccc12)-c1ccc(F)cc1F

BDBM113954

CC1(Cc2ccc(Cl)c(Cl)c2)C(=O)Nc2ccc(cc12)S(=O)(=O)NC1CCCCC1

BDBM113955

Cc1cc(F)ccc1C(O)c1nc(c[nH]1)-c1cccc(OCc2ccccc2)c1

BDBM113956

CCN(Cc1cccc(Br)c1)c1c(CC)nc2ccc(cn12)C(=O)Nc1cccc(OC)c1

BDBM113957

OC(c1nc(cs1)-c1cccc(c1)C(F)(F)F)(c1ccccc1)C(F)(F)F

BDBM113958

COc1ccc(NC(=O)Cn2nnc(c2COc2ccc3ccccc3c2)-c2ccccc2)cn1

BDBM113959

OC(c1nc(cs1)-c1ccc2OCOc2c1)(c1ccccc1)C(F)(F)F

BDBM113960

CC(O)(c1nc(cs1)-c1cc2ccccc2o1)c1ccc(F)c(F)c1

BDBM113961

CCN(Cc1cccc(Br)c1)c1c(CC)nc2ccc(cn12)C(=O)Nc1ccc(OC)c(OC)c1

BDBM113962

COc1cc(ccc1F)C(O)c1nc(cs1)-c1ccc2ccccc2c1

BDBM83873

CC1(Cc2cccc(c2)C#N)C(=O)Nc2ccc(cc12)-c1cccc(c1)C(F)(F)F

BDBM113963

CC1(Cc2ccc(o2)C(F)(F)F)C(=O)Nc2ccc(cc12)-c1cccc(c1)C(F)(F)F

BDBM113964

CC(O)(c1nc(cs1)-c1cc2ccccc2o1)c1ccccc1

BDBM113965

C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)OCCCC[C@@H](C)Oc2ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc2C1=O

BDBM113966

Oc1ccc(C[C@H]2CNC(=S)N2CC2CCCN2C[C@H](Cc2ccccc2)N2C[C@H](Cc3ccc(O)cc3)N(CC3CCCCC3)C2=S)cc1

BDBM113967

CCOc1ccc(CCN2[C@@H](Cc3ccc(O)cc3)CN([C@H](CN3CCC[C@@H]3CN3[C@@H](CC(C)C)CNC3=S)Cc3ccc(O)cc3)C2=S)cc1

BDBM113968

CCOc1ccc(CCN2[C@@H](Cc3ccccc3)CN([C@H](CN3CCC[C@@H]3CN3[C@@H](CC(C)C)CNC3=S)Cc3ccc(O)cc3)C2=S)cc1

BDBM113969

Oc1ccc(C[C@H]2CNC(=S)N2C[C@H]2CCCN2C[C@H](Cc2ccccc2)N2C[C@H](Cc3ccc(O)cc3)N(CCc3ccccc3)C2=S)cc1

BDBM113970

FC(F)(F)Oc1ccccc1C(N1CCC(CC1)n1c2ccccc2[nH]c1=O)c1nnnn1-c1ccc2OCCOc2c1

BDBM113971

O=C1NCN(c2ccccc2)C11CCN(CC1)C(c1nnnn1Cc1ccccc1)c1cccc2ccccc12

BDBM113972

O=C(Nc1ccc2OCCOc2c1)C(N1CCC(Cc2ccccc2)CC1)c1ccnc2ccccc12

BDBM113973

CCCCC[C@@H](C)N1C[C@@H](COCc2ccccc2)Oc2cc(ccc2S1(=O)=O)N1CC[C@H](O)C1

BDBM113974

CCCCC[C@H](C)N1C[C@@H](COCc2ccccc2)Oc2cc(ccc2S1(=O)=O)N1CC[C@H](O)C1

BDBM113975

Nc1[nH]c(C(=O)c2ccccc2)c(c1C(=O)NCCc1c[nH]c2ccccc12)-c1cccc(c1)C(F)(F)F

BDBM113976

CC(C)(C)c1ccc(cc1)-c1nnc(SCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2nccs2)n1-c1ccc(Cl)cc1

BDBM113977

CCOc1ccc(cc1)-n1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2nccs2)nnc1-c1ccc(cc1)C(C)(C)C

BDBM113978

COc1cc(NC(=O)c2ccccc2)c(C)cc1NC(=O)CSc1nnc(-c2ccccc2F)n1-c1ccc(C)cc1

BDBM113979

Cc1ccc(cc1)-n1c(Cc2cccs2)nnc1SCC(=O)Nc1ccc(OCc2ccccc2)cc1

BDBM113980

Clc1ccc(cc1)-n1c(Cc2cccs2)nnc1SCC(=O)Nc1ccc(OCc2ccccc2)cc1

BDBM113981

COc1ccc(cc1)-n1c(Cc2cccs2)nnc1SCC(=O)Nc1ccc(OCc2ccccc2)cc1

BDBM113982

CCN(CC)c1ccc(NC(=O)CSc2nc3ccccc3c(=O)n2-c2ccc(C)cc2)cc1

BDBM113983

CC(=NNC(=O)CSc1nnc(-c2ccc(cc2)C(C)(C)C)n1-c1ccccc1)c1cccc2ccccc12 |w:2.2|

BDBM113984

O=C(CSc1nnc(-c2cccs2)n1Cc1ccco1)Nc1ccc(Oc2ccccc2)cc1

BDBM50063917

CC(C)C[C@H]([C@@H](C(=O)NO)O)C(=O)N[C@H](C(=O)NC)C(C)(C)C

BDBM113985

C[C@@H](COC(=O)C(C)(C)C)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@H](C)Oc2ccc(NC(=O)Nc3ccccc3)cc2C1=O

BDBM113986

CCCCCCCCNS(=O)(=O)C=Cc1ccccc1CNC(=O)OC(C)(C)C |w:12.11|

BDBM113987

CCCCCCCCN1C(=O)[C@@H](CC(=O)NCc2ccc(OC)c(OC)c2)C[C@@]2([C@H](O[C@H](C=C12)C(C)C)C1CC1)C(=O)OC |t:33|

BDBM113988

COC(=O)[C@]12C[C@H](CC(=O)NCCC(C)C)C(=O)N(Cc3cccc4ccccc34)C1=C[C@@H](O[C@@H]2C1CC1)C(C)C |c:33|

BDBM113989

CN1[C@H]2CC[C@H](CC(=O)NCC(F)(F)F)O[C@@H]2COc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2C1=O

BDBM113990

CN1[C@H]2CC[C@H](CC(=O)NCc3ccc(cc3)-c3ccccc3)O[C@@H]2COc2ccc(NC(=O)Nc3ccccc3F)cc2C1=O

BDBM44587

Oc1c(CC(=O)Nc2ccccc2)sc(=O)n1-c1ccccc1

BDBM113991

CC1CN(CC(C)O1)S(=O)(=O)c1ccc(NC(=O)c2cc(n[nH]2)-c2ccccc2O)cc1

BDBM38971

Cc1cccc(N2CCN(CC2)C(=O)c2ccc(CS(=O)(=O)c3ccccc3C)o2)c1C

BDBM113992

Cc1nc2ccc(cc2s1)S(=O)(=O)NCC(=O)NCc1ccc2OCOc2c1

BDBM37106

COC(=O)c1c(C)n(-c2ccc(OC)cc2)c2ccc(O)cc12

BDBM113993

O=C(N1CCC2(CC1)OCCO2)c1cc2CCCCCCc2s1

BDBM113994

CCOc1cc2c3N(C(=O)C22C(C#N)=C(N)Oc4cc(O)ccc24)C(C)(C)C=C(C)c3c1 |t:14,30|

BDBM113995

OC(=O)CCC(=O)c1c[nH]c2ccccc12

BDBM37275

Cc1ccccc1-c1noc(n1)-c1ccc(O)cc1

BDBM113996

CC1(O)N(Cc2ccccc2)C(=O)OC11CCCCC1

BDBM113997

Cc1cccc(c1)C1(OC(=O)c2ccccc12)c1cccc(C)c1

BDBM113998

CC(C)Nc1nc(NC(C)C)nc(n1)N(CCOc1ccc(Cl)cc1Cl)C#N

BDBM113999

Clc1cccc(NCc2nnc(SCc3ccc(Cl)cc3Cl)o2)c1

BDBM114000

COc1cccc(c1)C1C(C#N)C(=N)Oc2c1oc(CO)cc2=O

BDBM77167

O=C(CC(c1ccccc1)c1ccccc1)Nc1ccc2OCCOc2c1

BDBM44461

CCOC(=O)c1cc(OC(=O)c2ccccc2OC)n(n1)-c1ccccc1

BDBM114001

CCOc1ccc(c(C)c1C)S(=O)(=O)Nc1ccc(F)cc1

BDBM114002

O=C(Nc1cccc(c1)-c1csc(n1)-c1ccccc1)c1cccs1

BDBM114003

COc1ccccc1NC(=O)Cn1nc(-c2ccc(Cl)cc2)c2ccccc2c1=O

BDBM114004

Cc1ccccc1-c1nc(c(NCc2cccnc2)o1)S(=O)(=O)c1ccc(Br)cc1

BDBM114005

CCN1C(=S)N\C(=C/c2ccc(C)s2)C1=O

BDBM77289

Cc1cc(Oc2ccccc2)nc(SCC(=O)Nc2ccc(Cl)c(Cl)c2)n1

BDBM114006

CNC(=O)C1CC(=O)N=C(NN=C(C)c2cccs2)S1 |w:11.10,t:8|

BDBM114007

O=C1CC(Nc2ccc3ccccc3c2)C(=O)N1Cc1ccccc1

BDBM114008

Cc1csc(n1)-c1cnn(c1NC(=O)c1ccc(cc1)C(F)(F)F)-c1ccccc1

BDBM39719

Cc1cc(Nc2ccc(Cl)cc2)n(n1)-c1cccc(Cl)c1

BDBM114009

Cc1nn(Cc2ccccc2Cl)c2sc(cc12)C(=O)NCc1ccc2OCOc2c1

BDBM114010

Cc1noc(C)c1C(=O)OCC(=O)Nc1ccccc1Oc1ccccc1

BDBM78105

Nc1cc(Cl)ccc1Oc1ccc2ccccc2c1

BDBM114011

COc1ccc(OC)c(NC(=O)COC(=O)c2c3CCCCc3nc3ccccc23)c1

BDBM95903

Cc1ccc(cc1)-n1c(n[nH]c1=S)C1CC1c1ccc(Cl)cc1

BDBM114012

Clc1ccc(NC(C2CCCCC2=O)c2ccccc2)cc1

BDBM114013

CCOC(=O)c1c(C)c(C)sc1NC(=O)Cn1nc(cc1C(F)F)C(F)F

BDBM114014

COc1ccc(NC(C)C(=O)N\N=C\c2ccccc2OCc2ccc(Br)cc2)cc1

BDBM78128

Cc1cccc(Oc2cc(NC(=O)c3ccccc3)cc(c2)[N+]([O-])=O)c1

BDBM52423

CCOc1cc(ccc1O)C(c1c(C)[nH][nH]c1=O)c1c(C)[nH][nH]c1=O

BDBM114015

Cc1ccc(NC(=O)NNC(=O)Cn2nc(-c3ccccc3)c(-c3ccccc3)c(C#N)c2=O)cc1

BDBM46386

Cc1cc(C)n(Cc2ccc(NC(=O)c3ccc(COc4ccccc4Br)cc3)cc2)n1

BDBM114016

Cc1cccc(c1)C(N)=NOC(=O)N1CCOCC1 |w:9.10|

BDBM53389

CCOc1ccc(cc1)N=Nc1c2[nH]c(C)cc(=O)n2[nH]c1=O |w:10.11|

BDBM114018

Clc1ncc(COC(=O)c2cccc(Cl)c2Cl)s1

BDBM114019

CC(Oc1ccc(Cl)cc1)c1ccnn1S(=O)(=O)c1ccccc1

BDBM114020

O=C(Nc1cccc2ccccc12)c1ccc(OC(=S)N2CCOCC2)cc1

BDBM114021

OC(CN(c1ccccc1)S(=O)(=O)c1ccccc1)Cn1c2ccccc2c2ccccc12

BDBM57407

CC(=NNC(=N)Sc1cc(O)n(c1O)-c1ccc(Br)cc1)c1cccs1 |w:2.2|

BDBM114023

CC(=NNC(=N)Sc1cc(O)n(c1O)-c1ccccc1)c1cccs1 |w:2.2|

BDBM114024

O=C(NC(=S)Nc1ccc2OCCOc2c1)c1cccc2ccccc12

BDBM67948

S=c1[nH]nc(C2CCCCC2)n1N=CC=Cc1ccccc1 |w:12.13,14.15|

BDBM114026

Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc1ccc2CCc3cccc1c23

BDBM114027

CC(=O)Oc1ccc(cc1)C(=O)Nc1cccc(c1)C(=O)c1ccc(C)c(C)c1

BDBM114028

CCc1cc(C(=O)OC)c(NC(=O)C2CC(=O)NN2Cc2ccccc2)s1

BDBM114029

COc1ccc(CN(C(C(=O)NC2CCCC2)c2ccc(C)cc2)C(=O)c2nsc(Cl)c2Cl)cc1

BDBM114030

Cc1ccc(OCCOCCOc2ccc(Br)cc2\C=N/NC(=O)c2ccncc2)cc1

BDBM114031

Clc1ccc(OCCOCCOc2cccc3cccnc23)c(Br)c1

BDBM61048

Cc1ccc(cc1)S(=O)(=O)N(Cc1ccc(Cl)cc1)c1ccccc1C(=O)NCc1ccco1

BDBM72166

COC(=O)c1cccc(Cn2c(Cl)c(CN=Nc3ccccc3C)sc2=O)c1 |w:16.16|

BDBM79676

CCC(N1C(=S)S\C(=C/c2cccn2C)C1=O)C(O)=O

BDBM114033

COc1cc(SC)ccc1C(=O)NCCOc1ccc(C)c(C)c1

BDBM114034

Cc1ccc(\C=C\C(=O)Nc2ccc(Oc3ccccc3)cc2)o1

BDBM31354

COc1ccc(cc1)C(CC(=O)c1ccc(C)cc1)Nc1ccc(cc1)[N+]([O-])=O

BDBM114035

NS(=O)(=O)c1ccc(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)cc1

BDBM114036

CCCn1c(SCC(=O)N2c3ccccc3Sc3ccccc23)nc2ccccc12

BDBM44653

COc1ccc(NC(=O)c2oc3ccccc3c2NC(=O)C(C)(C)C)cc1

BDBM114037

Cc1ccc(o1)C(N(Cc1ccccc1)C(=O)Cc1c[nH]c2ccccc12)C(=O)NC1CCCCC1

BDBM50239

Cc1[nH]n(-c2ncc(s2)-c2ccccc2)c(=O)c1C(C(C#N)C#N)c1ccc(Br)cc1

BDBM114038

CCCN1C\C(=C\c2ccc3OCOc3c2)C(=O)\C(C1)=C\c1ccc2OCOc2c1

BDBM114039

COc1cc(NC(=O)CC(C)=NNC(=O)Cc2ccccc2)c(OC)cc1Cl |w:11.11|

BDBM114040

CCOc1ccc(CNC(=S)NN=Cc2ccc(OC)c(OC)c2)cc1 |w:12.11|

BDBM114041

N=C1N2C(SC=C2c2ccccc2)=NC(=O)\C1=C/c1cccn1CCOc1ccccc1 |c:5,14|

BDBM50255

COc1ccc(cc1)N1CCC(CNC(=S)Nc2cccc(OC)c2)C1

BDBM114042

Cc1ccccc1-n1c(SCC(=O)N\N=C\C=C\c2ccccc2[N+]([O-])=O)nc2ccccc2c1=O |(9.75,-4.62,;9.75,-6.16,;8.41,-6.93,;8.41,-8.47,;9.75,-9.24,;11.08,-8.47,;11.08,-6.93,;12.42,-6.16,;12.42,-4.62,;11.08,-3.85,;11.08,-2.31,;9.75,-1.54,;8.41,-2.31,;9.75,,;8.41,.77,;8.41,2.31,;7.08,3.08,;7.08,4.62,;5.75,5.39,;4.41,4.62,;3.08,5.39,;3.08,6.93,;4.41,7.7,;5.75,6.93,;7.08,7.7,;7.08,9.24,;8.41,6.93,;13.75,-3.85,;15.08,-4.62,;16.46,-3.8,;17.86,-4.59,;17.86,-6.19,;16.46,-6.98,;15.08,-6.16,;13.75,-6.93,;13.75,-8.47,)|

BDBM114043

CCNC(=S)NN=Cc1cn(Cc2ccccc2F)c2ccccc12 |w:6.5|

BDBM70806

N=c1c2C(c3ccccc3)c3c(Oc2ncn1Cc1ccco1)ccc1ccccc31

BDBM51041

Cn1c2cccc3C(=O)c4ccccc4-c(c(Nc4ccc(O)cc4)c1=O)c23

BDBM114044

[#6]-c1ccc(cc1)S(=O)(=O)[#7](-[#6]-[#6]-[#6]-[#8])-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6]-1\c2ccccc2-c2ccccc-12

BDBM114045

Brc1ccc(CN2CCc3c(OCC(=O)N4CCCc5ccccc45)cccc3C2=O)cc1

BDBM114046

COc1ccc(cc1)\N=C1/SC(CC(=O)Nc2ccc(F)cc2)C(=O)N1Cc1ccco1

BDBM114047

CC(Sc1nc2ccccc2c(=O)n1-c1cc(C)cc(C)c1)C(=O)NCc1ccc2OCOc2c1

BDBM114048

CCc1ccc(NC(=O)CO\N=C(/C)c2cc3ccccc3o2)cc1

BDBM114049

CN(C)S(=O)(=O)c1cc(NC(=O)COC(=O)C(=C\c2cccs2)\c2cccs2)ccc1C

BDBM114050

COc1ccc(cc1)N(C)S(=O)(=O)c1cccc(c1)C(=O)OC(C(=O)Nc1cc(C)cc(C)c1)c1ccccc1

BDBM114051

CC(C)C(NS(=O)(=O)c1c(Cl)cccc1Cl)C(=O)OCC(=O)c1c[nH]c2ccccc12

BDBM55033

CCOc1ccc(\C=C\C(=O)c2cc(Br)ccc(=O)c2O)cc1

BDBM114052

COc1ccc(OC)c(NC(=O)COC(=O)Cc2ccc(cc2)-c2ccccc2)c1

BDBM114053

Cc1cc(C)n(CCc2nc(cs2)-c2ccc(cc2)C(C)(C)C)n1

BDBM114054

COc1cc(\C=C(/C#N)c2ccccn2)ccc1OCc1ccccc1

BDBM114055

Cc1cc(C(=O)OC(C(=O)Nc2ccc(C)cc2)c2ccccc2)c(C)o1

BDBM44065

Cc1cccc(Nc2nnc(SCC(=O)c3ccc(Br)s3)s2)c1C

BDBM114056

CCOC(=O)c1c(NC(=O)CSc2nncs2)scc1-c1ccccc1

BDBM114057

[O-][N+](=O)c1ccc(Cl)c(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1nc2ccc(F)cc2s1

BDBM34807

CC(C)N=c1scc(-c2cccs2)n1N=Cc1ccc(O)c(O)c1O |w:14.15,3.2|

BDBM114058

COc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cccs3)ccc2N2CCCC2)cc1

BDBM114059

FC(F)Oc1ccccc1NC(=O)COC(=O)c1cccc(NS(=O)(=O)\C=C\c2ccccc2)c1

BDBM114060

Clc1ccccc1-n1c(SCC(=O)Nc2cccc(c2)S(=O)(=O)N2CCOCC2)nc2ccccc2c1=O |(12.42,-1.54,;12.42,-3.08,;11.08,-3.85,;11.08,-5.39,;12.42,-6.16,;13.75,-5.39,;13.75,-3.85,;15.08,-3.08,;15.08,-1.54,;13.75,-.77,;13.75,.77,;12.42,1.54,;11.08,.77,;12.42,3.08,;11.08,3.85,;11.08,5.39,;9.75,6.16,;8.41,5.39,;8.41,3.85,;9.75,3.08,;7.08,3.08,;6.31,4.41,;7.85,1.75,;5.75,2.31,;5.75,.77,;4.41,,;3.08,.77,;3.08,2.31,;4.41,3.08,;16.42,-.77,;17.75,-1.54,;19.13,-.72,;20.52,-1.51,;20.52,-3.11,;19.13,-3.9,;17.75,-3.08,;16.42,-3.85,;16.42,-5.39,)|

BDBM114061

FC(F)Oc1ccc(\C=C\C(=O)OCC(=O)Nc2ccc(cc2)S(=O)(=O)N2CCCC2)cc1

BDBM114062

CN(c1ccccc1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1ccc2nc(C)sc2c1

BDBM114063

CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)c2cccc(c2)S(=O)(=O)N2CCc3ccccc3C2)c1

BDBM114064

CC(OC(=O)CCCCCN=C1NS(=O)(=O)c2ccccc12)C(=O)Nc1cc(Cl)cc(Cl)c1 |w:10.9|

BDBM114065

CN(C)S(=O)(=O)c1cccc(NC(=O)c2cc(nn2-c2cccc(Cl)c2)-c2cccs2)c1

BDBM114066

COc1ccc(NS(=O)(=O)c2ccc(OC)c(NC(=O)CCC3CCCC3)c2)cc1

BDBM114067

COc1cc(C=NNC(=O)c2cc(nc3ccccc23)-c2ccccc2OC(C)C)ccc1O |w:6.6|

BDBM114068

CC1CCc2c(C1)scc2-c1n[nH]c(=S)n1CC=C

BDBM114069

CCOc1cccc(OCCOc2ccc(cc2)C(=O)c2ccccc2)c1

BDBM114070

CC(C)(C)c1ccc(cc1)-c1nc(NCc2cccnc2)c2ccccc2n1

BDBM114071

O=C(C[n+]1ccccc1)Nc1nc2ccccc2s1

BDBM114072

CCOc1ccc(NC(=O)Cc2sc(=O)n(c2O)-c2ccccc2)cc1

BDBM114073

COc1cc(OC)cc(c1)-c1cn[nH]c1N

BDBM114074

Cc1ccc(NC2=C(OC(=O)c3ccc(C)cc3)OC(=O)C2Cl)cc1 |c:6|

BDBM114075

COc1ccccc1\C=C\C1N2C(=O)CCSC2=NC(C)=C1C(=O)OCC(C)C |c:19,22|

BDBM82783

CCN(c1ccccc1)S(=O)(=O)c1cc(ccc1C)C(=O)OC(C)C(=O)Nc1ccc2OCCOc2c1

BDBM114076

CC(OC(=O)c1cc(=O)[nH]c2ccc(cc12)S(=O)(=O)Nc1cccc(C)c1)C(=O)Nc1ccc(cc1)[N+]([O-])=O

BDBM90473

COc1cccc(CNc2ccc(cc2C)[N+]([O-])=O)c1

BDBM114077

C[C-](\N=[NH+]\c1ccc(cc1)[N+]([O-])=O)c1ccc(C)cc1C

BDBM88044

Clc1ccc(COc2ccsc2-c2n[nH]c(=S)[nH]2)c(Cl)c1

BDBM114078

Nc1cc(ccc1Oc1ccc(Cl)cc1)S(=O)(=O)N1CCCCC1

BDBM114079

Fc1ccc(cc1)C(CNC(=O)c1ccc(Br)o1)N1CCOCC1

BDBM114080

CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)Nc2ccccc2)c2ccccc12 |c:21|

BDBM114081

OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)Nc2ccccc2)C2CCCCC2)cc1 |c:11|

BDBM114082

CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c1csc2ccccc12)C(=O)Nc1ccccc1 |c:5|

BDBM53163

Cc1cccc(NNC2=c3cc(Br)ccc3=NC2=O)c1 |c:8,16|

BDBM114083

Cc1ccccc1NC1=NC(=O)C(S1)=Cc1cccn1C |w:14.16,t:9|

BDBM37867

OC(CS)C(O)CSC(=O)c1cccs1

BDBM114084

C[C@H](NC(=O)c1nc[nH]c1C(=O)NC(c1ccccc1)c1ccccc1)C(=O)OCc1ccccc1

BDBM53405

COc1ccc(cc1)C1CC(O)(Oc2c(C)ccc(C)c12)c1ccccc1

BDBM114085

COc1ccc(cc1)S(=O)(=O)Nc1ccc(Nc2ccccc2)cc1

BDBM114086

Clc1ccc(cc1)C1NC(=O)NC1=O

BDBM114087

OCCCn1c(nc2cc(Cl)c(Cl)cc12)C1CCCN1c1nc(cs1)-c1ccc(F)cc1

BDBM114088

Oc1ccc(Cl)cc1NC(=O)C1CC(=NO1)c1c(F)cccc1Cl |c:14|

BDBM114089

COc1ccc(cc1OC)-c1n[nH]c(=S)n1-c1ccc(Br)cc1

BDBM114090

CCSc1nsc(NC(=O)Nc2cccc(OC)c2)n1

BDBM114091

Cc1ccc(CN2C(=O)[C@H]3Cc4c([nH]c5ccccc45)C(C)(C)N3C2=O)cc1

BDBM114092

COc1cccc(CN2C(=O)[C@@H]3Cc4c([nH]c5ccccc45)C(C)(C)N3C2=O)c1

BDBM114093

COC(=O)C1=C(C[C@@H]2CC[C@H]1N2C(=O)NCc1ccc(cc1)C(F)(F)F)c1cc2ccccc2s1 |t:4,TLB:2:4:11:8.9|

BDBM114094

CCOc1ccc(-c2n[nH]cc2-c2ccc(Cl)cc2)c(O)c1

BDBM90869

COC(=O)c1ccc(CN2C(=O)C(C)N(C(=O)c3c(F)cccc3F)c3ccccc23)cc1

BDBM65622

[O-][N+](=O)CC(c1ccccc1)P(=O)(c1ccccc1)c1ccccc1

BDBM114095

Cc1ccccc1-c1nnn(Cc2ccc(F)cc2Cl)n1

BDBM114096

CN(Cc1ccc(F)cc1)C(=O)c1cccc(OCc2ccccc2)c1

BDBM114097

CN(c1ccc(OCc2ccc(cc2)[N+]([O-])=O)cc1)S(=O)(=O)c1ccccc1

BDBM114098

NS(=O)(=O)c1ccc(cc1)\[NH+]=N\C=C\[CH-]c1ccccc1[N+]([O-])=O

BDBM114099

COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2c(C)noc2\C=C\N(C)C)cc1

BDBM114100

Nc1cc(OC(=O)c2c(F)cccc2Cl)nn1S(=O)(=O)c1ccccc1

BDBM61642

Cc1c(sc2nc(C)nc(N3CCCCC3)c12)C(=O)Nc1ccc2OCCOc2c1

BDBM114101

COc1ccc(cc1)C1=NS(=O)(=O)N(C)C(=C1)C(=O)Nc1ccc(C)cc1 |c:16,t:9|

BDBM114102

CN1C(=CC(=NS1(=O)=O)c1ccc(C)cc1)C(=O)Nc1ccc2OCOc2c1 |c:2,4|

BDBM114103

Cc1cccc(N2CCN(CC2)C(=O)c2ccc(CS(=O)Cc3ccc(Cl)cc3)o2)c1C

BDBM114104

COc1ccccc1CNS(=O)(=O)c1cc(ccc1C(C)C)-c1cc(C)no1

BDBM88241

Cc1ccc(cc1)S(=O)(=O)Nc1cc(Cl)c(O)c2ncccc12

BDBM114105

CC(OC(=O)c1cnc(C)cn1)C(=O)Nc1ccc2OCCOc2c1

BDBM114106

Clc1ccc(CNC(=S)Nc2ccncc2)cc1

BDBM71876

COc1cc(cc(OC)c1O)-c1nc(c([nH]1)-c1ccc2c(c1)-c1ccccc1S2(=O)=O)-c1ccccc1

BDBM114107

COc1ccc(cc1)S(=O)(=O)NCC(N1CCc2ccccc12)c1ccco1

BDBM50035

CN(C)c1ccc(NC(=O)c2ccc(COc3cccc(Cl)c3)o2)cc1

BDBM114108

COCCOc1ccc(cc1NC(=O)CN1C(=O)NC(C)(C1=O)c1ccc2OCOc2c1)C(F)(F)F

BDBM114109

Cc1ccc(cc1NC(=O)CNc1ccc(cc1)C(F)(F)F)S(=O)(=O)N1CCCCC1

BDBM51550

CC1CCCN(CCCNC(=O)c2coc3nc4ccccc4nc23)C1

BDBM114110

CCOC(=O)c1sc(NC(=O)CN2C(=O)NC3(CC(C)CC(C)(C)C3)C2=O)cc1C

BDBM50035245

CCCCC[C@H](CC(=O)NO)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1CO

BDBM114111

Clc1ccc(cc1NC(=O)CN1C(=O)c2ccccc2S1(=O)=O)S(=O)(=O)N1CCCCC1

BDBM96402

COc1ccccc1N(C)S(=O)(=O)c1ccc(cc1)C(=O)NNC(=O)c1ccccc1O

BDBM114112

COc1ccc(OC)c(c1)-c1csc(NC(=O)COC(=O)C2(C)CC2(Cl)Cl)n1

BDBM114113

CCc1noc(C)c1C(=O)OC(C)C(=O)Nc1ccc2OCOc2c1

BDBM114114

CCN(CC)S(=O)(=O)c1cc(NC(=O)Cc2ccc(s2)S(=O)(=O)N2CCOCC2)ccc1Cl

BDBM114115

O=C(NCC1COc2ccccc2O1)c1cccc(c1)S(=O)(=O)N1CCN(CC1)c1ccccc1

BDBM114116

CN(CC(=O)Nc1cccc(F)c1)C(=O)c1ccccc1OCc1cccc(C)c1

BDBM114117

COc1ccc(S[C@@H](CCN2CC[C@H](C)CCC2=O)c2ccccc2)cc1

BDBM114118

[H][C@]12COc3ccc(C)cc3[C@]1([H])N1C(=O)CN(Cc3ccc(Cl)cc3)C(=O)[C@@]1(C)[C@H]2c1ccccc1

BDBM114119

COC(=O)C1=C(C[C@@H]2CC[C@H]1N2C(=O)NCc1cccc(c1)C(F)(F)F)c1ccc(F)cc1OCc1ccccc1 |t:4,TLB:2:4:11:8.9|

BDBM114120

COC(=O)C1=C(C[C@@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1)c1ccccc1OCc1ccccc1 |t:4,TLB:2:4:11:8.9|

BDBM114121

COC(=O)C1=C(C[C@@H]2CC[C@H]1N2C(=O)NCCOc1ccc(OC)cc1)c1cccc(OCc2ccccc2)c1 |t:4,TLB:2:4:11:8.9|

BDBM114122

OC[C@H](Cc1ccccc1)NC(=O)C[C@@H](CC=C)C(=O)N1CCC[C@H]1COC(=O)[C@@H](CCC=C)Cc1ccc(F)cc1

BDBM114123

OC[C@H](Cc1ccccc1)NC(=O)C[C@H]1C\C=C/CC[C@@H](Cc2ccc(F)cc2)C(=O)O[C@H](CNC1=O)c1ccccc1 |c:17|

BDBM114124

COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)S(=O)(=O)c4cccs4)[C@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1

BDBM114125

C[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccs2)Oc2ccc(NC(=O)Nc3ccc4OCOc4c3)cc2CC1=O

BDBM66340

COc1ccc(CNC(=O)CN(Cc2ccc(Cl)cc2)S(=O)(=O)c2ccccc2)cc1

BDBM70598

COc1cc(ccc1OCc1ccc(cc1)[N+]([O-])=O)C(c1c(C)[nH][nH]c1=O)c1c(C)[nH][nH]c1=O

BDBM114126

CCOC(=O)c1ccc(NC(=O)C2CCCN(C2)S(=O)(=O)c2ccc(F)cc2)cc1

BDBM114127

[O-][N+](=O)c1ccc(cc1)[C@@H]1[C-](N[N+](=C1C(=O)N1CCOC1=O)c1ccc(Br)cc1)c1ccccc1 |c:13|

BDBM91349

Cc1cc2oc(=O)cc(-c3ccccc3)c2c(C)c1-c1ccc(O)cc1

BDBM114128

Clc1ccc(CC2(NC(=O)NC2=O)c2ccccc2)cc1

BDBM114129

CCOC(=O)C1=CN(Cc2cccc(F)c2)S(=O)(=O)NC1c1ccc2ccccc2c1 |t:5|

BDBM114130

Oc1cc([O-])ccc1\C=[NH+]\NC(=O)C(CSCc1ccccc1)NC(=O)c1ccc(cc1)[N+]([O-])=O

BDBM114131

CCCCN(Cc1ccccc1)S(=O)(=O)c1cc2N(C(C)Cc2cc1Br)C(C)=O

BDBM114132

COc1cccc(c1)C(=O)c1c(ncc2cc(OC)c(OC)cc12)-c1ccccc1

BDBM51989

Cn1c(n[nH]c1=S)-c1sccc1OCc1ccc(Cl)cc1Cl

BDBM61021

Cc1ccc(cc1)C(=O)N1CCN(CC1)C1C(NS(=O)(=O)c2ccccc2)c2cccc3cccc1c23

BDBM114133

CCOC(=O)CC(SP1(=S)OCC2(CCCCO2)C(O1)C1CCCCO1)C(=O)OCC

BDBM114134

Cc1ccc(CC2(NC(=O)NC2=O)c2ccccc2)cc1

BDBM114135

Clc1cccc(NC(=O)OCCOCCOC(=O)Nc2cccc(Cl)c2)c1

BDBM88675

ClCCN(CCCl)c1ccc(C=NNC(=O)C(=O)c2c[nH]c3ccccc23)cc1

BDBM114136

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)Nc1cccc(c1)C(=O)NCCCCc1ccccc1

BDBM114137

CCCn1c(CCNc2nc(cs2)-c2cccc(Br)c2)nc2ccccc12

BDBM53380

[H][C@]1(c2cccc(OC3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2C(=O)c2c(O)cc(cc12)C(O)=O)[C@]1([H])c2cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2C(=O)c2c(O)cc(cc12)C(O)=O

BDBM114138

COc1ccc(Cn2cc(CN3CCS(=O)(=O)N(Cc4ccc(cc4)-c4cccc(Cl)c4)C(C)C3=O)nn2)cc1

BDBM114139

COc1ccc(cc1OC)-c1ccc(CN2C(C(C)C)C(=O)N(Cc3cn(Cc4ccco4)nn3)CCS2(=O)=O)cc1

BDBM114140

CCN(Cc1cccc(Br)c1)c1c(CC)nc2ccc(cn12)C(=O)Nc1ccc2NC(=O)COc2c1

BDBM114141

COc1cccc(c1)C(NC(C)=O)c1nc(cs1)-c1ccc2ccccc2c1

BDBM114142

OC(c1nc(cs1)-c1cccc(c1)C(F)(F)F)c1ccc(F)c(F)c1

BDBM114143

CC(C)c1cccc(c1)-c1csc(n1)C(O)c1cccc(Cl)c1

BDBM114144

O=C(Nc1cccc(c1)C#N)c1cc(on1)C1CCCCN1S(=O)(=O)c1ccccc1

BDBM114145

COc1ccc(NC(=O)C2(C)Cc3c(O2)nccc3-c2cccc(c2)C(F)(F)F)cn1

BDBM42653

COc1ccc(cc1)-c1cnc(N)nc1-c1ccc(OCC(C)=C)cc1O

BDBM114146

CCc1nc2ccc(cn2c1N(C)Cc1nccs1)C(=O)Nc1cc(ccc1OC)-c1ccccc1

BDBM114147

Cc1ccc(cc1)S(=O)(=O)N1C[C@@H]2[C@H](C[C@H]1c1cccc3ccccc13)N([C@@H](CC2=O)c1ccccc1)S(=O)(=O)c1ccc(C)cc1

BDBM114148

CCOC(=O)\C=C1/CN(Cc2ccc(OC)cc2)S(=O)(=O)c2ccccc12

BDBM114149

COc1ccc(cc1)C(N1CCN(C\C=C\c2ccccc2)CC1)c1nnnn1Cc1ccccc1

BDBM114150

CCC(N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1nnnn1Cc1ccccc1

BDBM114151

CC(C)(C)S(=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccc(F)c1)C(=O)NCC(F)(F)F

BDBM114152

Cc1ccc(cc1)S(=O)(=O)N1CCN([C@H](COC(=O)Nc2ccccc2)Cc2ccccc2)C(=O)CC1

BDBM114153

C[C@@H](N1C[C@H](COCc2ccccc2)Oc2cc(ccc2S1(=O)=O)N1CC[C@@H](O)C1)c1ccccc1

BDBM114154

CCCCC[C@@H](C)N1C[C@@H](COCc2ccccc2)Oc2cc(ccc2S1(=O)=O)N1CCC[C@H]1CO

BDBM114155

COc1cccc(c1)C(Nc1ccccc1)c1ccc2ccc(C)nc2c1O

BDBM114156

Nc1[nH]c(C(=O)c2ccc(Br)cc2)c(c1C(=O)NCCc1c[nH]c2ccccc12)-c1ccccn1

BDBM114157

Nc1[nH]c(C(=O)c2ccc(Br)cc2)c(c1C(=O)NCCc1c[nH]c2ccccc12)-c1ccc(Cl)cc1[N+]([O-])=O |(9.21,.93,;10.75,.93,;11.66,2.18,;13.12,1.7,;14.37,2.6,;15.78,1.97,;14.21,4.13,;12.81,4.76,;12.65,6.29,;13.89,7.2,;13.74,8.73,;15.3,6.57,;15.46,5.04,;13.12,.16,;11.65,-.32,;11.18,-1.78,;12.2,-2.93,;9.67,-2.1,;9.19,-3.56,;7.68,-3.88,;7.2,-5.34,;8.1,-6.58,;7.2,-7.82,;5.75,-7.35,;4.41,-8.12,;3.08,-7.35,;3.08,-5.81,;4.41,-5.04,;5.75,-5.81,;14.36,-.75,;14.2,-2.28,;15.44,-3.19,;16.85,-2.56,;18.1,-3.47,;17.02,-1.03,;15.77,-.13,;17.18,.5,;18.42,-.41,;17.34,2.03,)|

BDBM114158

COC(=O)C1=C(C)N(Cc2ccc(Br)cc2)C(=S)NC1c1ccc(F)cc1 |c:4|

BDBM114159

COC(=O)C1=C(C)N(Cc2cccc(c2)C(F)(F)F)C(NCc2ccc3OCOc3c2)=NC1c1ccc(F)cc1 |c:4,33|

BDBM114160

CCOC(=O)C1=C(C2N(Cc3ccc(cc3)C#N)c3ccccc3[C@@]22C[C@H](N(C2=N1)S(=O)(=O)c1ccc(OC)cc1)C(=O)OC)C(=O)OCC |c:32,t:5|

BDBM114161

Clc1ccc(cc1)-n1c(COc2ccccc2)nnc1SCC(=O)Nc1ccccc1-c1ccccc1

BDBM114162

Cc1ccc(OCc2nnc(SC\C=C\c3ccccc3)n2Cc2ccco2)cc1

BDBM114163

C(Sc1nnc(-c2ccccn2)n1-c1ccccc1)c1cccc2ccccc12

BDBM114164

CCOc1ccc(cc1)-n1c(SCC(=O)Nc2cc(C)c(NC(=O)c3ccccc3)cc2OC)nnc1-c1cccs1

BDBM114165

Cc1cccc(NC(=O)CSc2nnc(SCc3ccc(Cl)cc3)s2)c1

BDBM114166

Cc1ccc(cc1C)-c1cc([nH]n1)C(=O)NN=Cc1cccc(OCc2ccccc2)c1 |w:16.17|

BDBM114167

O=C(CSc1nc2ccccc2o1)NN=C\C=C\c1ccccc1

BDBM114168

Cc1sc2nc(SCC(=O)c3ccc(O)c(O)c3)n(Cc3ccco3)c(=O)c2c1C

BDBM114169

Cc1cc(N2CCN(CC2)C(=O)Oc2ccc(cn2)-c2ccccc2)c2ccccc2n1

BDBM114170

Clc1cccc(CN2CCCCC(NC(=O)c3ccc(COc4ccccc4)cc3)C2=O)c1

BDBM114171

CCOC(=O)N1CCN(CC1)C(=O)C[C@H]1C[C@@]2([C@H](O[C@H](C=C2N(Cc2ccc(Cl)cc2Cl)C1=O)C(C)C)C1CC1)C(=O)OC |c:21|

BDBM114172

COC(=O)[C@H](CC(C)C)N(CCc1cn(Cc2ccccc2)nn1)S(=O)(=O)c1ccccc1Br

BDBM114173

COC(=O)[C@]12C[C@H](CC(=O)NCCCCc3ccccc3)C(=O)N(Cc3cccc4ccccc34)C1=C[C@@H](O[C@@H]2C1CC1)C(C)C |c:39|

BDBM114174

COC(=O)[C@H](CC(C)C)N1Cc2nnn(Cc3ccc(C)cc3)c2-c2cc(F)ccc2S1(=O)=O

BDBM114175

COc1cccc(CC(=O)N(Cc2ccccc2)c2ccccc2C(=O)Nc2cc(OC)ccc2OC)c1

BDBM114176

Clc1ccc(NC(=O)CN2CCN(CC2)c2nc(cs2)-c2ccccc2)cc1Cl

BDBM125923

Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCCCC2)C(=O)NO)c2ccccc2n1

BDBM125925

Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCOCC2)C(=O)NO)c2ccccc2n1

BDBM175076

CC#CCOc1ccc(cc1)C(=O)NC[C@H](N1CCN(CC1)S(C)(=O)=O)C(=O)NO

BDBM175083

Cc1cc(COc2ccc(cc2)C(=O)NC[C@H](N2CCN(CC2)S(C)(=O)=O)C(=O)NO)c2ccccc2n1

BDBM175093

ONC(=O)C(CNC(=O)c1ccc(OCc2c(nn3ccccc23)C(F)(F)F)cc1)N1CCN(Cc2ccccc2)CC1

BDBM175095

CC1(C)SCCN(C1C(=O)NO)S(=O)(=O)c1ccc(OCC#CCO)cc1

BDBM207964

Cc1cc(COc2ccc(cc2)C(=O)NC[C@H](N2CCCCC2)C(=O)NO)c2ccccc2n1

BDBM207966

ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccnc(c2)-c2ccccc2)cc1)N1CCCCC1

BDBM207967

ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccncc2)cc1)N1CCCCC1

BDBM207973

CCN(CC)[C@@H](CNC(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM50181008

CC1(C)SCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(OCC#CCO)cc1 |r|

BDBM113577

Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCN(CC2)S(C)(=O)=O)C(=O)NO)c2ccccc2n1

BDBM113588

Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCN(Cc3ccc(F)cc3)CC2)C(=O)NO)c2ccccc2n1

BDBM113589

CCN1CCN(CC1)[C@@H](CNS(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM235932

Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)C(=O)NO)c2ccccc2n1

BDBM113590

Cc1ccc(CN2CCN(CC2)[C@@H](CNS(=O)(=O)c2ccc(OCc3cc(C)nc4ccccc34)cc2)C(=O)NO)cc1

BDBM113591

CC(C)C(=O)N1CCN(CC1)[C@@H](CNS(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM113592

CC(C)CS(=O)(=O)N1CCN(CC1)[C@@H](CNS(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM113593

CC(C)S(=O)(=O)N1CCN(CC1)[C@@H](CNS(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM50228006

Cc1cccc(c1)C1=CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO |t:8|

BDBM50227993

CCc1cccc(c1)C1=CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO |t:9|

BDBM50228007

CC(C)c1cccc(c1)C1=CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO |t:10|

BDBM50227985

COc1cccc(c1)C1=CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO |t:9|

BDBM50228002

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCC(=CC1)c1cccc(c1)C1CC1 |c:19|

BDBM50227983

COC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(C=C1)c1ccccc1)C(=O)NO |w:17.22,c:20|

BDBM50203538

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CC=C(C1)c1ccccc1 |c:18|

BDBM50227996

CC(C)COC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(C=C1)c1ccccc1)C(=O)NO |w:20.25,c:23|

BDBM50203537

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCC(CC1)c1ccccc1

BDBM50203526

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCC(=CC1)c1ccccc1 |c:19|

BDBM50228005

Cc1cccc(c1)N1CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO

BDBM50228003

Cc1cc(ccc1C#N)N1CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO

BDBM50227992

ONC(=O)[C@H]1CC2(CC2)CN([C@@H]1C(=O)N1CCC(C=C1)c1ccccc1)C(=O)OCc1ccccc1 |w:17.22,c:20|

BDBM50227997

CC(C)c1cccc(c1)C1CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO

BDBM50227998

CC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(C=C1)c1ccccc1)C(=O)NO |w:16.21,c:19|

BDBM50227991

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCC(=CC1)c1cc(F)cc(F)c1 |c:19|

BDBM50227995

Cc1cccc(c1)C1CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO

BDBM50227994

CS(=O)(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO

BDBM50227999

COC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(C1)c1ccccc1)C(=O)NO |w:17.21|

BDBM50227986

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCC(C1)c1ccccc1 |r|

BDBM50228001

ONC(=O)[C@H]1CC2(CC2)CN([C@@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)OC1CCOCC1

BDBM50227982

CS(=O)(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(C=C1)c1ccccc1)C(=O)NO |w:17.22,c:20|

BDBM50227990

Cc1cc(cc(C)c1C#N)C1=CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO |t:11|

BDBM50227981

COC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CC=C(C1)c1ccccc1)C(=O)NO |c:18|

BDBM50203529

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50228004

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCN(CC1)c1cccc(Cl)c1

BDBM50227989

COC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(CC1)c1ccccc1)C(=O)NO

BDBM50228000

CC(C)c1cc(ccc1C#N)C1=CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO |t:12|

BDBM50227987

Cc1cc(C)cc(c1)C1=CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO |t:9|

BDBM50229646

Cc1ccccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC[C@H]1CCCN1)C(=O)NO

BDBM50229661

Cc1ccccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC[C@@H]1CCCN1)C(=O)NO

BDBM50229654

Cc1cc(ccc1N1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO)C#N

BDBM50229648

Cc1cc(cc(C)c1C#N)C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO

BDBM50229651

Cc1cc(ccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC[C@@H]1CCCN1)C(=O)NO)C#N

BDBM50229636

Cc1cc(ccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC[C@H]1CCCN1)C(=O)NO)C#N

BDBM50229653

Cc1cc(C)cc(c1)C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO

BDBM50229638

ONC(=O)C1(CS(=O)(=O)N2CCC(CC2)c2ccccc2C(F)(F)F)CCN(CC1)C(=O)O[C@H]1CCOC1

BDBM50229652

CN(C)C(=O)c1ccc(C2CCN(CC2)S(=O)(=O)CC2(CCN(CC2)C(=O)O[C@H]2CCOC2)C(=O)NO)c(C)c1

BDBM50229639

ONC(=O)C1(CS(=O)(=O)N2CCC(=CC2)c2ccccc2)CCN(CC1)C(=O)O[C@H]1CCOC1 |c:12|

BDBM50229663

Cc1cc(ccc1C1=CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO)C#N |t:8|

BDBM50229662

Cc1cc(F)ccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO

BDBM50229643

Cc1cc(ccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO)C#N

BDBM50229641

Cc1cc(ccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC1CCNC1)C(=O)NO)C#N |w:26.28|

BDBM50229642

ONC(=O)C1(CS(=O)(=O)N2CCC(CC2)c2ccccc2F)CCN(CC1)C(=O)O[C@H]1CCOC1

BDBM50229644

ONC(=O)C1(CS(=O)(=O)N2CCC(CC2)c2ccccc2)CCN(CC1)C(=O)O[C@H]1CCOC1

BDBM50229656

Cc1ccccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC1CCNC1)C(=O)NO |w:26.28|

BDBM50229660

Cc1ccccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC1(C)CCOC1)C(=O)NO |w:26.29|

BDBM50229649

ONC(=O)C1(CS(=O)(=O)N2CCC(CC2)c2ccccc2C#N)CCN(CC1)C(=O)O[C@H]1CCOC1

BDBM50229645

Cc1cc(ccc1C1=CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC[C@@H]1CCCN1)C(=O)NO)C#N |t:8|

BDBM50229659

ONC(=O)C1(CS(=O)(=O)N2CC=C(C2)c2ccccc2)CCN(CC1)C(=O)O[C@H]1CCOC1 |c:11|

BDBM50229655

Cc1ccccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC1CCCC1O)C(=O)NO |w:26.28,30.34|

BDBM50229647

Cc1cc(ccc1C1=CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC[C@H]1CCCN1)C(=O)NO)C#N |t:8|

BDBM50229658

ONC(=O)C1(CS(=O)(=O)N2CCC(C2)c2ccccc2)CCN(CC1)C(=O)O[C@H]1CCOC1 |w:12.14|

BDBM50229650

Cc1ccccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO

BDBM50229635

Cc1ccccc1C1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)OC1COCC1(C)C)C(=O)NO |w:26.28|

BDBM50229634

ONC(=O)C1(CS(=O)(=O)N2CCC(CC2)c2ccc(cc2)C#N)CCN(CC1)C(=O)O[C@H]1CCOC1

BDBM50229637

Cc1ccccc1N1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO

BDBM50229657

ONC(=O)C1(CS(=O)(=O)N2CCN(CC2)c2ccccc2)CCN(CC1)C(=O)O[C@H]1CCOC1

BDBM50229640

Cc1ccccc1C1=CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@H]1CCOC1)C(=O)NO |t:8|

BDBM50302107

COC(=O)[C@@H]1CCCN1C(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](OC(=O)[C@@H](OC(=O)[C@H](C(C)C)N(C)C)C(C)C)C(C)C)[C@@H](C)O |r|

BDBM50062351

CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO |r|

BDBM50156476

CC(C)C(NC(=O)C(\NC(=O)c1ccccc1)=C/c1ccccc1F)C(O)=O

BDBM50156477

OC(=O)CNC(=O)C(\NC(=O)c1ccco1)=C/c1cccc(Br)c1

BDBM50156478

CC(NC(=O)C(\NC(=O)c1ccco1)=C/c1ccco1)C(O)=O

BDBM50203527

COC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(=CC1)c1ccccc1)C(=O)NO |r,c:19|

BDBM50203536

ONC(=O)[C@H]1CCCN[C@@H]1C(=O)N1CC[C@@H](C1)c1ccccc1

BDBM50203524

Cc1ccccc1N1CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO

BDBM50203533

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CC[C@@H](C1)c1ccccc1

BDBM50203534

CN1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO |r|

BDBM50203535

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCN2C(Cc3ccccc23)C1

BDBM50203525

CC1=C(CCN(C1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO)c1ccccc1 |t:1|

BDBM50203528

CN1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(=CC1)c1ccccc1)C(=O)NO |c:16|

BDBM50203531

Cc1cc(ccc1C1=CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO)[N+]([O-])=O |t:8|

BDBM50203530

Cc1cc(ccc1N1CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO)[N+]([O-])=O

BDBM50104618

O=C1NC[C@@H](Cc2ccccc2)N(C[C@@H]2CCCN2C[C@@H](CC2CCCCC2)N2C[C@H](Cc3ccccc3)N(CCc3ccccc3)C(=O)C2=O)C1=O |r|

BDBM50104619

Oc1ccc(C[C@H]2CN([C@H](CN3CCC[C@H]3CN3[C@@H](Cc4ccccc4)CNC(=O)C3=O)Cc3ccccc3)C(=O)C(=O)N2CCC23CC4CC(CC(C4)C2)C3)cc1 |r,TLB:45:46:49:53.51.52,THB:51:50:47:53.52.54,51:52:49.50.55:47,54:52:49:55.46.47,54:46:49:53.51.52|

BDBM50104620

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@@H](CC1CCCCC1)N1C[C@H](Cc2ccccc2)N(CCc2ccccc2)C(=O)C1=O |r|

BDBM50104621

Oc1ccc(C[C@H]2CN([C@H](CC3CCCCC3)CN3CCC[C@H]3CN3[C@@H](Cc4ccccc4)CNC(=O)C3=O)C(=O)C(=O)N2CCc2ccccc2)cc1 |r|

BDBM50104622

Oc1ccc(C[C@@H]2CNC(=O)C(=O)N2C[C@@H]2CCCN2C[C@@H](Cc2ccc3ccccc3c2)N2C[C@H](Cc3ccc(O)cc3)N(CCC34CC5CC(CC(C5)C3)C4)C(=O)C2=O)cc1 |r,TLB:56:47:54:50.51.52,THB:52:51:48:54.53.55,52:53:50.51.56:48,56:51:54:47.48.55,46:47:54:50.51.52|

BDBM50104623

CCCC[C@H]1CN([C@H](CN2CCC[C@H]2CN2[C@H](Cc3ccc4ccccc4c3)CNC(=O)C2=O)Cc2ccc(O)cc2)C(=O)C(=O)N1CCC12CC3CC(CC(C3)C1)C2 |r,TLB:58:49:56:52.53.54,THB:48:49:56:52.53.54,54:53:50:56.55.57,54:55:52.53.58:50,58:53:56:49.50.57|

BDBM50104624

Oc1ccc(C[C@@H](CN2CCC[C@H]2CN2[C@H](Cc3ccc4ccccc4c3)CNC(=O)C2=O)N2C[C@@H](Cc3ccc4ccccc4c3)N(CCC34CC5CC(CC(C5)C3)C4)C(=O)C2=O)cc1 |r,TLB:59:50:57:53.54.55,THB:49:50:57:53.54.55,55:54:51:57.56.58,55:56:53.54.59:51,59:54:57:50.51.58|

BDBM50104625

Oc1ccc(C[C@@H](CN2CCC[C@H]2CN2[C@H](Cc3ccc4ccccc4c3)CNC(=O)C2=O)N2C[C@H](Cc3ccc4ccccc4c3)N(CCC34CC5CC(CC(C5)C3)C4)C(=O)C2=O)cc1 |r,TLB:59:50:57:53.54.55,THB:49:50:57:53.54.55,55:54:51:57.56.58,55:56:53.54.59:51,59:54:57:50.51.58|

BDBM50104626

Oc1ccc(C[C@@H](CN2CCC[C@H]2CN2[C@H](Cc3ccc4ccccc4c3)CNC(=O)C2=O)N2C[C@@H](Cc3ccc(O)cc3)N(CCC34CC5CC(CC(C5)C3)C4)C(=O)C2=O)cc1 |r,TLB:56:47:54:50.51.52,THB:52:51:48:54.53.55,52:53:50.51.56:48,46:47:54:50.51.52,56:51:54:47.48.55|

BDBM50104627

Oc1ccc(C[C@@H](CN2CCC[C@H]2CN2[C@H](Cc3ccc4ccccc4c3)CNC(=O)C2=O)N2C[C@H](Cc3ccc(O)cc3)N(CCC34CC5CC(CC(C5)C3)C4)C(=O)C2=O)cc1 |r,TLB:56:47:54:50.51.52,THB:52:51:48:54.53.55,52:53:50.51.56:48,46:47:54:50.51.52,56:51:54:47.48.55|

BDBM50104628

CCCC[C@H]1CN([C@H](CN2CCC[C@H]2CN2[C@@H](CCC)CNC(=O)C2=O)Cc2ccc(O)cc2)C(=O)C(=O)N1CCC12CC3CC(CC(C3)C1)C2 |r,TLB:50:41:48:44.45.46,THB:40:41:48:44.45.46,46:45:42:48.47.49,46:47:44.45.50:42,50:45:48:41.42.49|

BDBM50104629

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@@H](Cc2ccc3ccccc3c2)N(CCC23CC4CC(CC(C4)C2)C3)C(=O)C1=O |r,TLB:53:44:51:47.48.49,THB:43:44:51:47.48.49,49:48:45:51.50.52,49:50:47.48.53:45,53:48:51:44.45.52|

BDBM50104630

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@H](Cc2ccc3ccccc3c2)N(CCC23CC4CC(CC(C4)C2)C3)C(=O)C1=O |r,TLB:53:44:51:47.48.49,THB:43:44:51:47.48.49,49:48:45:51.50.52,49:50:47.48.53:45,53:48:51:44.45.52|

BDBM50104631

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@@H](Cc2ccc(O)cc2)N(CCC23CC4CC(CC(C4)C2)C3)C(=O)C1=O |r,TLB:50:41:48:44.45.46,THB:46:45:42:48.47.49,46:47:44.45.50:42,50:45:48:41.42.49,40:41:48:44.45.46|

BDBM50104632

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@H](Cc2ccc(O)cc2)N(CC2CCCC2)C(=O)C1=O |r|

BDBM50104633

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@H](Cc2ccc(O)cc2)N(CCC23CC4CC(CC(C4)C2)C3)C(=O)C1=O |r,TLB:50:41:48:44.45.46,THB:46:45:42:48.47.49,46:47:44.45.50:42,50:45:48:41.42.49,40:41:48:44.45.46|

BDBM50104634

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@H](Cc2ccc(O)cc2)N(CC(CC)c2ccccc2)C(=O)C1=O |r|

BDBM50104635

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@H](Cc2ccc(O)cc2)N(CC2CCC2)C(=O)C1=O |r|

BDBM50104636

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@H](Cc2ccc(O)cc2)N(CC2CCCCC2)C(=O)C1=O |r|

BDBM50104637

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@H](Cc2ccc(O)cc2)N(CC23CC4CC(CC(C4)C2)C3)C(=O)C1=O |r,TLB:47:42:49:46.45.48,47:46:49:43.42.41,THB:45:44:41:47.46.48,45:46:43.44.49:41|

BDBM50104638

CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]1CCCN1C[C@H](Cc1ccc(O)cc1)N1C[C@H](Cc2ccc(O)cc2)N(CC2CCC(CC2)C(C)(C)C)C(=O)C1=O |r,wU:12.12,29.32,wD:3.2,18.20,(-5.07,-1.38,;-4,-.77,;-2.67,-1.54,;-1.33,-.77,;,-1.54,;1.33,-.77,;1.33,.77,;2.4,1.39,;,1.54,;,2.77,;-1.33,.77,;-2.67,1.54,;-2.67,3.08,;-1.43,3.96,;-1.91,5.43,;-3.45,5.43,;-3.92,3.96,;-5.38,3.48,;-6.53,4.5,;-7.99,4.01,;-9.15,5.04,;-8.83,6.54,;-9.98,7.57,;-11.45,7.09,;-12.37,7.91,;-11.76,5.58,;-10.61,4.55,;-6.22,6.01,;-4.76,6.49,;-4.45,8,;-2.99,8.49,;-2.68,10,;-3.83,11.02,;-3.52,12.53,;-2.06,13.01,;-1.82,14.22,;-.91,11.99,;-1.21,10.48,;-5.6,9.02,;-5.28,10.53,;-6.43,11.56,;-7.89,11.08,;-9.04,12.1,;-8.73,13.61,;-7.27,14.09,;-6.12,13.07,;-9.88,14.64,;-10.8,15.46,;-11.05,14.25,;-9.63,15.84,;-7.06,8.54,;-7.98,9.36,;-7.37,7.03,;-8.35,6.71,)|

BDBM50227984

CC(C)c1cccc(c1)N1CCN(CC1)C(=O)[C@H]1NCC2(CC2)C[C@@H]1C(=O)NO

BDBM50227988

ONC(=O)[C@H]1CC2(CC2)CN[C@@H]1C(=O)N1CCC(=CC1)c1cc(Cl)cc(Cl)c1 |c:19|

BDBM26806

ONC(=O)[C@H]1COCC[C@H]1NC(=O)c1ccc(Cn2c(nc3ccccc23)C(F)(F)F)cc1 |r|

BDBM50265157

CN1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(=O)NO |r|

BDBM50264775

Cc1cc(ccc1N1CCN(CC1)S(=O)(=O)CC1(CCN(CC1)C(=O)O[C@@H]1CCOC1)C(=O)NO)C#N |r|

BDBM50265114

C[C@H]1C[C@](CC(=O)NO)(C[C@@H](C)N1)NC(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1 |r|

BDBM50264814

CC#CCOc1ccc(cc1)S(=O)(=O)N[C@H]([C@H](C)O)C(=O)NO |r|

BDBM50268904

ONC(=O)[C@H]1CC(CC(=O)NCCCCCNC(=O)OCc2ccccc2)CN[C@@H]1C(=O)N1CCC(C1)c1ccccc1 |r|

BDBM50268905

NCCCCCNC(=O)CC1CN[C@@H]([C@H](C1)C(=O)NO)C(=O)N1CCC(C1)c1ccccc1 |r|

BDBM50268906

ONC(=O)[C@H]1CC(CC(=O)N2CCCC2)CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50268951

CN1CC(CC(=O)N2CCCC2)C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO |r|

BDBM50268952

CN1CC(CC(=O)N2CCCCC2)C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO |r|

BDBM50268953

ONC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50268954

ONC(=O)[C@H]1CC2(CC2)CC[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50268999

ONC(=O)[C@H]1CC(CC(=O)N2CCCC2)CC[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50269000

ONC(=O)[C@H]1CC(CC(=O)N2CCCCC2)CC[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50269001

CN1CCN(CC1)C(=O)CC1CC[C@@H]([C@H](C1)C(=O)NO)C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50269002

ONC(=O)[C@H]1CC(CC(=O)N2CCOCC2)CC[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50269056

ONC(=O)[C@H]1CC(CC(=O)N2CC[C@@H](O)C2)CC[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50269057

ONC(=O)[C@H]1C[C@@H](CC(=O)N2CCCCC2)CC[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50269058

ONC(=O)[C@H]1C[C@H](CC(=O)N2CCCCC2)CC[C@@H]1C(=O)N1CCN(CC1)c1ccccc1 |r|

BDBM50269059

CC(C)c1cccc(c1)C1CCN(CC1)C(=O)[C@H]1CC[C@H](CC(=O)N2CCCCC2)C[C@@H]1C(=O)NO |r|

BDBM50269100

CC(C)c1cccc(c1)C1CCN(CC1)C(=O)[C@H]1CC[C@@H](CC(=O)N2CCCCC2)C[C@@H]1C(=O)NO |r|

BDBM50151245

CNC(=O)[C@@H](NC(=O)[C@H](CCCc1ccccc1)[C@H](C)N(O)C=O)C(C)(C)C |r|

BDBM50151246

Cc1cc(ccc1N2CCN(CC2)S(=O)(=O)N3CSC[C@@H]3C(=O)NO)C#N

BDBM50151244

Cc1cc(ccc1N1CCN(CC1)S(=O)(=O)N[C@H](CCCNC(=O)OCc1ccccc1)C(=O)NO)C#N |r|

BDBM50441213

ONC(=O)[C@@H](CCCNC(=O)OCc1ccccc1)NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1 |r|

BDBM50292680

ONC(=O)[C@H]1C[C@]1(Cc1ccc(OCc2cc(nc3ccccc23)-c2ccccc2)cc1)C#N |r|

BDBM50292681

OC[C@@H]1CCCN1C(=O)[C@@]1(Cc2ccc(OCc3cc(nc4ccccc34)-c3ccccc3)cc2)C[C@@H]1C(=O)NO |r|

BDBM50292682

CN(C)C(=O)[C@@]1(Cc2ccc(OCc3cc(nc4ccccc34)-c3ccccc3)c(F)c2)C[C@@H]1C(=O)NO |r|

BDBM26524

NC(=O)[C@@]1(Cc2ccc(OCc3cc(nc4ccccc34)-c3ccccc3)c(F)c2)C[C@@H]1C(=O)NO |r|

BDBM23487

Cc1cc(COc2ccc(C[C@@]3(C[C@@H]3C(=O)NO)C(N)=O)cc2)c2ccccc2n1 |r|

BDBM50292683

CCOC(=O)[C@@]1(Cc2ccc(OCc3cc(nc4ccccc34)-c3ccccc3)cc2)C[C@@H]1C(=O)NO |r|

BDBM50292684

CCOC(=O)[C@@]1(Cc2ccc(OCc3cc(C)nc4ccccc34)cc2)C[C@@H]1C(=O)NO |r|

BDBM50309132

c1ccc(c(c1)N2CCN(CC2)C(=O)[C@@H]([C@H](C(=O)NCCc3cccs3)O)O)Cl

BDBM50309147

O[C@H]([C@@H](O)C(=O)N1CCCC1c1cccc(Cl)c1)C(=O)NCCc1cccs1 |r|

BDBM50309153

O[C@H]([C@@H](O)C(=O)N1CCCC1c1ccccc1)C(=O)NCc1cc2ccccc2o1 |r|

BDBM50309154

O[C@H]([C@@H](O)C(=O)N1CCCC1c1ccccc1)C(=O)NCCc1cc(Cc2ccccc2)cs1 |r|

BDBM50313839

Fc1ccc(cc1)[C@]1(CN2Cc3ccc(Cl)cc3C2=O)NC(=O)NC1=O |r|

BDBM8465

COc1ccc(cc1)S(=O)(=O)N(Cc1cccnc1)[C@H](C(C)C)C(=O)NO |r|

BDBM50314220

CC(=O)NCC[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NO |r|

BDBM50314222

CC#CCOc1ccc(cc1)S(=O)(=O)N[C@H](CCNC(=O)OCc1ccccc1)C(=O)NO |r|

BDBM50314223

CC#CCOc1ccc(cc1)S(=O)(=O)N[C@H](CCN1C(=O)c2ccccc2C1=O)C(=O)NO |r|

BDBM50314224

CC#CCOc1ccc(cc1)S(=O)(=O)N(CC(C)C)[C@H](CCN1C(=O)c2ccccc2C1=O)C(=O)NO |r|

BDBM50332283

COc1ccc2CN(C[C@]3(NC(=O)NC3=O)C#Cc3cccnc3)C(=O)c2c1 |r|

BDBM50342963

C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1cccc(Cl)c1)c1ccc(cc1)-n1cccn1 |r|

BDBM50342945

C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1csc(NC2CC2)n1)c1ccc(cc1)-n1cccn1 |r|

BDBM50342959

CNc1nc(cs1)[C@@H]1N(Cc2ccccc12)C(=O)[C@H](O)[C@@H](O)C(=O)N[C@H](C)c1ccc(cc1)-n1cccn1 |r|

BDBM50343959

O[C@H]([C@@H](O)C(=O)N1CCCC1c1cccc(Cl)c1)C(=O)NCc1ccc(cc1)-n1cccn1 |r|

BDBM50236675

Cc1cc(COc2ccc(cc2)S(=O)(=O)N2CCN(C(C2)C(=O)NO)C(=O)C(C)(C)C)c2CCCCc2n1

BDBM50240415

COc1ccc(cc1)S(=O)(=O)N(CC(=O)NO)Cc1cccc(c1)C(O)=O

BDBM50243038

COc1ccc2CN(C[C@]3(NC(=O)NC3=O)c3cc4cnccc4o3)C(=O)c2c1 |r|

BDBM50301103

ONC(=O)[C@H]1CC(CC(=O)N2CCCC2)CN[C@@H]1C(=O)N1CCC(=CC1)c1ccccc1 |r,c:25|

BDBM50301104

ONC(=O)[C@H]1CC(CN[C@@H]1C(=O)N1CCC(=CC1)c1ccccc1)OC(=O)N1CCCC1 |r,c:16|

BDBM50301105

CC(C)C(=O)N(C)C1CN[C@@H]([C@H](C1)C(=O)NO)C(=O)N1CCC(=CC1)c1ccccc1 |r,c:23|

BDBM50301106

CN(C1CN[C@@H]([C@H](C1)C(=O)NO)C(=O)N1CCC(=CC1)c1ccccc1)C(=O)c1ccccc1 |r,c:18|

BDBM50301107

CC(C)OC(=O)N(C)C1CN[C@@H]([C@H](C1)C(=O)NO)C(=O)N1CCC(=CC1)c1ccccc1 |r,c:24|

BDBM50301108

ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCC(CC1)c1ccccc1)OC(=O)N1CCCC1 |r|

BDBM50301109

ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1)OC(=O)N1CCCC1 |r|

BDBM50301110

ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CC=C(C1)c1ccccc1)OC(=O)N1CCCC1 |r,c:15|

BDBM50378414

ONC(=O)[C@H]1CC(CN[C@@H]1C(=O)N1CC[C@@H](C1)c1ccccc1)OC(=O)N1CCCC1 |r|

BDBM50301112

ONC(=O)[C@H]1CC(CN[C@@H]1C(=O)N1Cc2ccccc2C1)OC(=O)N1CCCC1 |r|

BDBM50301113

CN1C[C@H](C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO)OC(=O)N1CCCC1 |r|

BDBM50301114

COC(=O)N1C[C@H](C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO)OC(=O)N1CCCC1 |r|

BDBM50301115

CN(C)C(=O)O[C@H]1C[C@@H]([C@H](N(C)C1)C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO |r|

BDBM50301102

CN1C[C@H](C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO)OC(=O)N1CCC1 |r|

BDBM50301116

CN1C[C@H](C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO)OC(=O)N1CC=CC1 |r,c:33|

BDBM50301117

CN1C[C@H](C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO)OC(=O)N1CCC(F)(F)C1 |r|

BDBM50301118

CN1C[C@H](C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO)OC(=O)N1CCCCC1 |r|

BDBM50301119

CN1C[C@H](C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO)OC(=O)N1CCCCCC1 |r|

BDBM50301120

CN1C[C@H](C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO)OC(=O)N1CCCCCCC1 |r|

BDBM50301121

ONC(=O)[C@H]1C[C@H](CN[C@@H]1C(=O)N1CCC(=CC1)c1ccccc1)OC(=O)N1CCCC1 |r,c:16|

BDBM50301124

NCCCCNC(=O)CC1CN[C@@H]([C@H](C1)C(=O)NO)C(=O)N1CCC(C1)c1ccccc1 |r|

BDBM50301101

ONC(=O)[C@H]1CC(CC(=O)N2CCCC2)CN[C@@H]1C(=O)N1CC[C@@H](C1)c1ccccc1 |r|

BDBM50301122

CC(C)C(=O)N(C)C1CN[C@@H]([C@H](C1)C(=O)NO)C(=O)N1CC[C@@H](C1)c1ccccc1 |r|

BDBM50301123

CN(C1CN[C@@H]([C@H](C1)C(=O)NO)C(=O)N1CC[C@@H](C1)c1ccccc1)C(=O)c1ccccc1 |r|

BDBM50302109

CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](OC(=O)[C@@H](OC(=O)[C@H](C(C)C)N(C)C)C(C)C)C(C)C)[C@@H](C)O)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|

BDBM50302108

CC[C@H](C)[C@@H](O)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N(C)[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)OC |r|

BDBM50441212

NC(=O)NCCC[C@@H](NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1)C(=O)NO |r|

BDBM50441214

ONC(=O)[C@@H](CCNC(=O)OCc1ccccc1)NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1 |r|

BDBM50441215

ONC(=O)CNS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1

BDBM50367253

ONC(=O)[C@H]1C[C@@H](CC[C@@H]1C(=O)N1CCC(CC1)c1ccccc1)OC(=O)N1CCCC1 |r|

BDBM50453825

CC(C)C(=O)N1CC(C1)(N(C)S(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM50453823

CC(C)CC(=O)N1CC(C1)(N(C)S(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO

BDBM50533418

CNC(=O)[C@@H](NC(=O)[C@H](CCCc1ccccc1)[C@H](C)N(O)C(C)=O)C(C)(C)C |r|

BDBM379557

Cc1ccc(Cl)cc1N1CCN(CC1)C(=O)CCC1(NC(=O)NC1=O)C1CC1

BDBM50575718

Clc1cc(Cl)cc(c1)N1CCN(CC1)C(=O)CC[C@H]1NC(=O)NC1=O |r|

BDBM50601784

CNC(=O)[C@@H](NC(=O)C(CCCc1ccccc1)[C@H](C)N(O)C=O)C(C)(C)C |r|

BDBM50421688

c1cc(cc(c1)C(=O)NCCCC(=O)NCCC[C@H](C(=O)NO)NS(=O)(=O)c2ccc(cc2)OCc3cc(cc(c3)Br)Br)C(=O)NCCCC(=O)NCCC[C@H](C(=O)NO)NS(=O)(=O)c4ccc(cc4)OCc5cc(cc(c5)Br)Br

BDBM50421689

ONC(=O)[C@@H](CCCNC(=O)c1cccc(c1)C(=O)NCCC[C@@H](NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1)C(=O)NO)NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1 |r|

BDBM50421690

ONC(=O)[C@@H](CCCNC(=O)NCCC[C@@H](NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1)C(=O)NO)NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1 |r|