C3AR1

Reference Set (100 Compounds)

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000096171994

ZINC000096171994 (search)

N=C(N)NCCC[C@H](NC(=O)CSCC(c1ccccc1)c1ccccc1)C(=O)O ZINC000299836969

ZINC000299836969 (search)

NC(N)=NCCC[C@H](NC(=O)CNCC(c1ccccc1)c1ccccc1)C(=O)O ZINC000034024252

ZINC000034024252 (search)

N=C(N)NCCC[C@H](NC(=O)CCCC(c1ccccc1)c1ccccc1)C(=O)O ZINC000299837980

ZINC000299837980 (search)

N=C(N)NCCC[C@H](NC(=O)c1c[nH]c(C(c2ccccc2)c2ccccc2)n1)C(=O)O ZINC000299838638

ZINC000299838638 (search)

N=C(N)NCCC[C@H](NC(=O)COCC(c1ccccc1)c1ccccc1)C(=O)O ZINC000003973385

ZINC000003973385 (search)

Cc1oc(C(c2ccccc2)c2ccccc2)nc1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000143828911

ZINC000143828911 (search)

Cc1[nH]c(C(c2ccccc2)c2ccccc2)nc1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000299837541

ZINC000299837541 (search)

N=C(N)NCCC[C@H](NC(=O)c1nc(C(c2ccccc2)c2ccccc2)no1)C(=O)O ZINC000299838875

ZINC000299838875 (search)

N=C(N)NCCC[C@H](NC(=O)c1coc(C(c2ccccc2)c2ccccc2)n1)C(=O)O ZINC000143836754

ZINC000143836754 (search)

Cc1c(C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)nc(C(c2ccccc2)c2ccccc2)n1C ZINC000299837065

ZINC000299837065 (search)

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O ZINC000084566603

ZINC000084566603 (search)

N=C(N)NCCC[C@H](NC(=O)c1ccc(C(c2ccccc2)c2ccccc2)o1)C(=O)O ZINC000028707108

ZINC000028707108 (search)

N=C(N)NCCC[C@H](NC(=O)c1noc(C(c2ccccc2)c2ccccc2)n1)C(=O)O ZINC000299838861

ZINC000299838861 (search)

N=C(N)NCCC[C@H](NC(=O)c1[nH]c(C(c2ccccc2)c2ccccc2)nc1-c1ccccc1)C(=O)O ZINC000143837201

ZINC000143837201 (search)

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000096172003

ZINC000096172003 (search)

N=C(N)NCCC[C@H](NC(=O)c1oc(C(c2ccccc2)c2ccccc2)nc1-c1ccccc1)C(=O)O ZINC000299820869

ZINC000299820869 (search)

Cc1nc(C(c2ccccc2)c2ccccc2)oc1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000299837558

ZINC000299837558 (search)

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000072122945

ZINC000072122945 (search)

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000096172001

ZINC000096172001 (search)

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O ZINC000096172004

ZINC000096172004 (search)

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000096171996

ZINC000096171996 (search)

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000095535829

ZINC000095535829 (search)

CCCC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O ZINC000096172002

ZINC000096172002 (search)

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000072124292

ZINC000072124292 (search)

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000072122856

ZINC000072122856 (search)

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000095540057

ZINC000095540057 (search)

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000095539430

ZINC000095539430 (search)

CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O ZINC000096171998

ZINC000096171998 (search)

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cccc2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000095539479

ZINC000095539479 (search)

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000095535837

ZINC000095535837 (search)

N=C(N)NCCC[C@H](NC(=O)c1nnc(C(c2ccccc2)c2ccccc2)o1)C(=O)O ZINC000299839332

ZINC000299839332 (search)

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000095539985

ZINC000095539985 (search)

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000072123375

ZINC000072123375 (search)

Cc1nc(C(c2ccccc2)c2ccccc2)n(C)c1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000143735113

ZINC000143735113 (search)

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000095539425

ZINC000095539425 (search)

CCCC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000072124653

ZINC000072124653 (search)

N=C(N)NCCC[C@@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H](CC1CCCCC1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O ZINC000096171993

ZINC000096171993 (search)

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O ZINC000096171999

ZINC000096171999 (search)

CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000096172006

ZINC000096172006 (search)

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000072124939

ZINC000072124939 (search)

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000096171995

ZINC000096171995 (search)

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000072126245

ZINC000072126245 (search)

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000095539776

ZINC000095539776 (search)

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000072125124

ZINC000072125124 (search)

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O ZINC000096172000

ZINC000096172000 (search)

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O ZINC000096172005

ZINC000096172005 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(C(c2cccc(Cl)c2)c2cccc(Cl)c2)o1)C(=O)O ZINC000028707195

ZINC000028707195 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(C(c2cccc(F)c2)c2cccc(F)c2)o1)C(=O)O ZINC000028707192

ZINC000028707192 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2F)CC1)[C@H](c1ccccc1)C1CCCCC1 ZINC000028818791

ZINC000028818791 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@@H](c1cccc(Cl)c1)[C@H]1C=CCCC1 ZINC000028818753

ZINC000028818753 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(-c2cccc(Cl)c2)o1)C(=O)O ZINC000028707127

ZINC000028707127 (search)

Cc1cccc([C@H](C(=O)NC2CCN(C(=O)CCc3cccnc3)CC2)C2CCCCC2)c1 ZINC000028818710

ZINC000028818710 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@@H](c1cc(F)c(F)c(F)c1)C1CCCCC1 ZINC000028818766

ZINC000028818766 (search)

Cc1cccc(-c2ccc(C(=O)N[C@H](CCCNC(=N)N)C(=O)O)o2)c1 ZINC000028707114

ZINC000028707114 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)o1)C(=O)O ZINC000028707198

ZINC000028707198 (search)

Cc1cc(C)cc([C@H](C(=O)NC2CCN(C(=O)CCc3cccnc3)CC2)C2CCCCC2)c1 ZINC000028818714

ZINC000028818714 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@@H](c1ccc(F)cc1)C1CCCCC1 ZINC000028818761

ZINC000028818761 (search)

CCOc1cccc(-c2ccc(C(=O)N[C@H](CCCNC(=N)N)C(=O)O)o2)c1 ZINC000028707119

ZINC000028707119 (search)

N#Cc1cccc(-c2ccc(C(=O)N[C@H](CCCNC(=N)N)C(=O)O)o2)c1 ZINC000028707124

ZINC000028707124 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(-c2ccc(F)c(Cl)c2)o1)C(=O)O ZINC000028707129

ZINC000028707129 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@@H](c1ccc(Cl)cc1)C1CCCCC1 ZINC000028818733

ZINC000028818733 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@H](c1ccsc1)C1CCCCC1 ZINC000028821886

ZINC000028821886 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(-c2cccc(F)c2)o1)C(=O)O ZINC000028707111

ZINC000028707111 (search)

COc1cccc(-c2ccc(C(=O)N[C@H](CCCNC(=N)N)C(=O)O)o2)c1 ZINC000028707117

ZINC000028707117 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(-c2csc3ccccc23)o1)C(=O)O ZINC000028707141

ZINC000028707141 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@H](c1ccccc1)C1CCCCC1 ZINC000028818626

ZINC000028818626 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@H](c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000028818772

ZINC000028818772 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)C1c2cc(Cl)ccc2Oc2ccc(Cl)cc21 ZINC000028818607

ZINC000028818607 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@@H](c1ccccc1)C1CCC(F)(F)CC1 ZINC000028818639

ZINC000028818639 (search)

COc1ccc([C@H](C(=O)NC2CCN(C(=O)CCc3cccnc3)CC2)C2CCCCC2)cc1 ZINC000028818720

ZINC000028818720 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(-c2cccc(CO)c2)o1)C(=O)O ZINC000028707122

ZINC000028707122 (search)

Cc1ccc(Cl)cc1-c1ccc(C(=O)N[C@H](CCCNC(=N)N)C(=O)O)o1 ZINC000028707132

ZINC000028707132 (search)

N=C(N)NCCC[C@@H](NC(=O)c1cccc(-c2cccc(Cl)c2)c1)C(=O)O ZINC000028707150

ZINC000028707150 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(C(c2ccccc2)c2ccccc2)cc1)C(=O)O ZINC000028707168

ZINC000028707168 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@@H](CC1CCCCC1)c1ccccc1 ZINC000028818644

ZINC000028818644 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@H](c1ccccc1)C1CCCC1 ZINC000028818649

ZINC000028818649 (search)

Cc1ccc([C@H](C(=O)NC2CCN(C(=O)CCc3cccnc3)CC2)C2CCCCC2)cc1 ZINC000028818658

ZINC000028818658 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@H](c1ccc2ccccc2c1)C1CCCCC1 ZINC000028818777

ZINC000028818777 (search)

CC1(C)CCC([C@@H](C(=O)NC2CCN(C(=O)CCc3cccnc3)CC2)c2ccccc2)CC1 ZINC000028818636

ZINC000028818636 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)C(C1CCCCC1)C1CCCCC1 ZINC000028818782

ZINC000028818782 (search)

O=C(NC1CCN(C(=O)/C=C/c2cccnc2)CC1)[C@H](c1ccccc1)C1CCCCC1 ZINC000028818802

ZINC000028818802 (search)

O=C(NC1CCN(C(=O)CCc2ccc(F)nc2)CC1)[C@H](c1ccccc1)C1CCCCC1 ZINC000028818797

ZINC000028818797 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(-c2cc(Cl)ccc2Cl)o1)C(=O)O ZINC000028707135

ZINC000028707135 (search)

Cc1ccc(C/N=C2\N=C(NCc3ccc(C)cc3)c3ccccc32)cc1 ZINC000026671979

ZINC000026671979 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@@H](c1ccccc1Cl)[C@H]1C=CCCC1 ZINC000028818745

ZINC000028818745 (search)

O=C(NC1CCN(C(=O)CCc2ccccc2F)CC1)[C@H](c1ccccc1)C1CCCCC1 ZINC000028818813

ZINC000028818813 (search)

Cc1ccccc1[C@H](C(=O)NC1CCN(C(=O)CCc2cccnc2)CC1)C1CCCCC1 ZINC000028818698

ZINC000028818698 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)C(c1ccccc1)c1ccccc1 ZINC000028818616

ZINC000028818616 (search)

O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)[C@H](c1ccccc1)C1CC=CC1 ZINC000028818654

ZINC000028818654 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(-c2cccc3c2oc2ccccc23)o1)C(=O)O ZINC000028707144

ZINC000028707144 (search)

CN(C)CCOc1ccc2c(c1)/C(=N/CCc1ccc(F)cc1)N=C2NCCc1ccc(F)cc1 ZINC000026673712

ZINC000026673712 (search)

C[C@H](C/N=C1\N/C(=N\C[C@H](C)c2ccc(Cl)cc2)c2ccccc21)c1ccc(Cl)cc1 ZINC000026718377

ZINC000026718377 (search)

CCCOc1ccc2c(c1)/C(=N/CCc1ccc(F)cc1)N=C2NCCc1ccc(F)cc1 ZINC000026675171

ZINC000026675171 (search)

Cc1ccc(CC/N=C2\N/C(=N\CCc3ccc(C)cc3)c3ccccc32)cc1 ZINC000026716380

ZINC000026716380 (search)

N=C(N)NCCC[C@@H](NC(=O)c1ccc(-c2cccc(Cl)c2)s1)C(=O)O ZINC000028707156

ZINC000028707156 (search)

Clc1ccc(CC/N=C2\N=C(NCCc3ccc(Cl)cc3)c3ccccc32)cc1 ZINC000026672330

ZINC000026672330 (search)

Clc1cccc(CC/N=C2\N/C(=N\CCc3cccc(Cl)c3)c3ccccc32)c1 ZINC000026718372

ZINC000026718372 (search)

CC(C)NC1=N/C(=N\CCc2ccc(Cl)cc2)c2ccccc21 ZINC000026672383

ZINC000026672383 (search)

O=C(NC1CCN(C(=O)Cc2cccc(F)c2F)CC1)[C@H](c1ccccc1)C1CCCCC1 ZINC000028818817

ZINC000028818817 (search)