Structures

Initial Fragments New Structures Literature Structures

Initial Fragments

ERI-UCB-ce40166b-17

O=C1CC(Oc2cc(Cl)cc(OCCNC(=O)c3cc(=O)[nH]c4ccccc34)c2)N1

View on Fragalysis N0029

MAT-POS-f2460aef-1

CC(C)(C)c1ccc(N(C(=O)c2ccco2)[C@H](C(=O)NCCc2cccc(F)c2)c2cccnc2)cc1

View on Fragalysis N0050

PET-UNK-c9c1e0d8-4

O=C1C(c2cccc(Cl)c2)CCN1c1cncc2ccccc12

View on Fragalysis N0066

AAR-POS-d2a4d1df-1

CS(=O)(=O)NCCc1ccccc1

View on Fragalysis x0072

AAR-POS-d2a4d1df-2

CC(=O)NCCc1c[nH]c2ccc(F)cc12

View on Fragalysis x0104

MAK-UNK-6435e6c2-8

CC(=O)Nc1cnccc1C

View on Fragalysis x0107

MAT-POS-7dfc56d9-1

COC(=O)c1ccc(S(N)(=O)=O)cc1

View on Fragalysis x0161

AAR-POS-0daf6b7e-44

CN1CCN(C(=O)Nc2ccccc2)CC1

View on Fragalysis x0165

AAR-POS-0daf6b7e-32

NC(=O)C1CCN(C(=O)Nc2ccccc2)CC1

View on Fragalysis x0177

AAR-POS-0daf6b7e-33

CC(=O)Nc1ccc(Oc2ncccn2)cc1

View on Fragalysis x0194

AAR-POS-d2a4d1df-4

CN1CCCc2ccc(S(N)(=O)=O)cc21

View on Fragalysis x0195

AAR-POS-d2a4d1df-5

CCNc1ccc(C#N)cn1

View on Fragalysis x0305

AAR-POS-0daf6b7e-45

CC(=O)NCc1ccc(S(N)(=O)=O)cc1

View on Fragalysis x0336

AAR-POS-0daf6b7e-36

Fc1cccc(CNCc2ccco2)c1

View on Fragalysis x0350

AAR-POS-d2a4d1df-6

Cc1ccc(OCC(=O)N2CCN(C)CC2)cc1

View on Fragalysis x0354

AAR-POS-0daf6b7e-43

O=C(c1ccc2c(c1)OCO2)N1CCCCCC1

View on Fragalysis x0376

AAR-POS-d2a4d1df-7

OC1CCN(Cc2ccsc2)CC1

View on Fragalysis x0387

AAR-POS-0daf6b7e-25

Oc1ccccc1CNc1nc2ccccc2[nH]1

View on Fragalysis x0390

AAR-POS-d2a4d1df-8

Cc1nnc(CN2CCC=C(F)C2)s1

View on Fragalysis x0395

AAR-POS-d2a4d1df-9

Cc1cc(CN(C)C(=O)NC2CC2)no1

View on Fragalysis x0397

AAR-POS-0daf6b7e-28

c1ccc(SCCN2CCOCC2)cc1

View on Fragalysis x0398

AAR-POS-0daf6b7e-27

c1cnc(N2CCC3(CCOC3)C2)cn1

View on Fragalysis x0425

AAR-POS-d2a4d1df-10

O=C(NCCc1ccncc1)c1ccccc1F

View on Fragalysis x0426

AAR-POS-d2a4d1df-11

O=C(Nc1ccccc1)Nc1cccnc1

View on Fragalysis x0434

MAK-UNK-6435e6c2-9

CC1C(O)CCCN1Cc1ccccc1

View on Fragalysis x0464

MAK-UNK-6435e6c2-7

COC(=O)c1cccc(NS(C)(=O)=O)c1

View on Fragalysis x0478

AAR-POS-0daf6b7e-41

NC(=O)c1ccc(NC(=O)[C@@H]2CCCO2)cc1

View on Fragalysis x0499

AAR-POS-d2a4d1df-12

O=C(NCCc1ccncc1)NC1CCCCC1

View on Fragalysis x0540

AAR-POS-0daf6b7e-29

Clc1cccc(CN2CCOCC2)c1

View on Fragalysis x0669

ALE-HEI-f28a35b5-9

O=C(CC1CCCCC1)Nc1cccnc1

View on Fragalysis x0678

MAK-UNK-6435e6c2-1

CC(=O)N1CCN(S(=O)(=O)c2cccs2)CC1

View on Fragalysis x0689

MAK-UNK-6435e6c2-5

CC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1

View on Fragalysis x0691

MAK-UNK-6435e6c2-6

CC(=O)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1

View on Fragalysis x0755

AAR-POS-d2a4d1df-14

NC(=O)[C@H]1CCC[C@H]1c1ccsc1

View on Fragalysis x0874

AAR-POS-0daf6b7e-22

OCC1(c2ccccn2)CCCC1

View on Fragalysis x0887

AAR-POS-d2a4d1df-15

NS(=O)(=O)c1ccc(Br)cc1

View on Fragalysis x0946

AAR-POS-d2a4d1df-16

CC(=O)NC(Cc1ccc(O)cc1)C(=O)NCC#CBr

View on Fragalysis x0967

AAR-POS-d2a4d1df-17

CCC(=N)N

View on Fragalysis x0991

AAR-POS-d2a4d1df-18

Nc1cncnc1

View on Fragalysis x0995

AAR-POS-0daf6b7e-37

Oc1ccccn1

View on Fragalysis x1002

AAR-POS-0daf6b7e-24

O=S1(=O)CC(O)C1

View on Fragalysis x1012

AAR-POS-d2a4d1df-19

N#Cc1ccc(N2CCCOCC2)cn1

View on Fragalysis x1077

AAR-POS-0daf6b7e-46

Cc1cc(F)ccc1CS(N)(=O)=O

View on Fragalysis x1086

AAR-POS-d2a4d1df-20

CN1CCN(C(=O)Cc2c[nH]c3ncccc23)CC1

View on Fragalysis x1093

AAR-POS-0daf6b7e-40

CC(C)N(C)c1ncnc2c1cnn2C

View on Fragalysis x1101

AAR-POS-0daf6b7e-42

Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1

View on Fragalysis x1119

AAR-POS-0daf6b7e-38

CC1CN(C(=O)Cn2cccn2)CCO1

View on Fragalysis x1132

AAR-POS-0daf6b7e-30

OCC1CN(Cc2ccccc2)CCO1

View on Fragalysis x1163

AAR-POS-0daf6b7e-23

Cn1ccc(C(=O)NC[C@@H]2CCCO2)n1

View on Fragalysis x1187

AAR-POS-0daf6b7e-34

CCNCc1cn(C)nn1

View on Fragalysis x1226

AAR-POS-0daf6b7e-35

COC(=O)Nc1sc(C)nc1-c1ccccc1

View on Fragalysis x1235

AAR-POS-0daf6b7e-39

CS(=O)(=O)Cc1nc2ccccc2[nH]1

View on Fragalysis x1237

AAR-POS-d2a4d1df-21

N#Cc1ccc(CNC(=O)N2CCOCC2)cc1

View on Fragalysis x1249

MAK-UNK-6435e6c2-4

CC(=O)Nc1cccc(N2CCCC2=O)c1

View on Fragalysis x1384

MAK-UNK-6435e6c2-3

CC(=O)N1CCN(Cc2ccsc2)CC1

View on Fragalysis x1386

New Structures

AAR-POS-5507155c-1

CS(=O)(=O)c1ccc(N2CCNCC2)cc1

View on Fragalysis x2193

BAR-COM-4e090d3a-39

O=C(Cc1cncnc1)Nc1cccc(OC2CC(=O)N2)c1

View on Fragalysis x2562

DAR-DIA-23aa0b97-20

O=C(Cc1cncc2ccccc12)Nc1ccccc1

View on Fragalysis x2563

DAR-DIA-23aa0b97-17

N#Cc1cncc(CC(=O)Nc2cccnc2)c1

View on Fragalysis x2569

TRY-UNI-714a760b-20

Cc1ccncc1NC(=O)Cc1cccc(C#N)c1

View on Fragalysis x2572

ALV-UNI-7ff1a6f9-47

COc1ccnc(NC(=O)Cc2ccc3ccccc3c2)c1

View on Fragalysis x2581

ANN-UNI-26382800-5

N#Cc1cccc(CC(=O)Nc2cccnc2)c1

View on Fragalysis x2600

DAR-DIA-842b4336-3

Cc1ccc(NC(=O)Nc2cccnc2)s1

View on Fragalysis x2608

DAR-DIA-842b4336-13

O=C(Cc1ccc(Cl)s1)Nc1cccnc1

View on Fragalysis x2643

TRY-UNI-714a760b-6

Cc1ccncc1NC(=O)Cc1cccc(Cl)c1

View on Fragalysis x2646

TRY-UNI-714a760b-18

Cc1ccncc1NC(=O)C(C)c1cccc(Cl)c1

View on Fragalysis x2649

MAK-UNK-0d6072ac-4

CC(C(=O)O)c1ccc2c(c1)[nH]c1ccc(Cl)cc12

View on Fragalysis x2659

BAR-COM-4e090d3a-49

N#CCOc1ccccc1C(=O)NCc1cnsc1

View on Fragalysis x2764

MAK-UNK-6435e6c2-2

CC(=O)N1CCN(Cc2cccs2)CC1

View on Fragalysis x2779

TRY-UNI-714a760b-12

Cc1ccncc1NC(=O)Nc1cccc(Cl)c1

View on Fragalysis x2908

MAT-POS-916a2c5a-2

COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2ccccc12

View on Fragalysis x2910

TRY-UNI-714a760b-22

Cc1ccncc1NC(=O)C(C)c1cccc(C#N)c1

View on Fragalysis x2912

DUN-NEW-d8381160-1

NC(=O)[C@@H]1CN(Cc2cccnc2)C[C@H]1c1ccccc1

View on Fragalysis x2929

DAR-DIA-23aa0b97-13

Nc1cncc(NC(=O)Nc2cccc(Cl)c2)c1

View on Fragalysis x2964

GAB-REV-70cc3ca5-8

Cc1ccncc1NC(=O)CN(C)S(=O)(=O)c1cccc2cccnc12

View on Fragalysis x3080

GAB-REV-70cc3ca5-13

Cc1ccncc1NC(=O)CNC(=O)Cc1cccnc1

View on Fragalysis x3108

BAR-COM-4e090d3a-57

O=C(Nc1ccccc1NS(=O)(=O)c1ccc(F)cc1)C(O)c1cccnc1

View on Fragalysis x3298

MAT-POS-916a2c5a-4

O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2ccccc2)CC1

View on Fragalysis x3303

BAR-COM-4e090d3a-47

Cn1cc(CNC(=O)N(CCc2ccccc2)Cc2cccnc2)nn1

View on Fragalysis x3305

DAR-DIA-eace69ff-36

CNCc1c[nH]c2ccc(F)cc12

View on Fragalysis x3351

GAB-REV-70cc3ca5-18

Cc1ccncc1NC(=O)Cc1ccc2nc[nH]c2c1

View on Fragalysis x3366

GAB-REV-70cc3ca5-4

Cc1ccncc1NC(=O)CNc1ccnc2ccccc12

View on Fragalysis x10019

BEN-DND-031a96cc-8

C=C(C(=O)Nc1ccccc1)c1cccnc1

View on Fragalysis x10022

DUN-NEW-f8ce3686-14

CS(=O)(=O)NCCN1CCCc2ccc(S(N)(=O)=O)cc21

View on Fragalysis x10049

DAR-DIA-23aa0b97-6

N#Cc1cncc(NC(=O)Cc2cccnc2)c1

View on Fragalysis x10178

EDG-MED-0da5ad92-2

O=C(Cc1cccc(Cl)c1)Nc1cccnc1

View on Fragalysis x10201

JOR-UNI-2fc98d0b-12

O=C(Nc1cccnc1)N(CCC1CCCCC1)c1cccc(Cl)c1

View on Fragalysis x10236

JOR-UNI-2fc98d0b-6

O=C(Nc1cccnc1)N(CCN1CCOCC1)c1cccc(Cl)c1

View on Fragalysis x10237

JAN-GHE-83b26c96-14

Cc1ccncc1NC(=O)Cc1cccc(C(F)(F)F)c1

View on Fragalysis x10247

JAN-GHE-83b26c96-11

Cc1ccc(CC(=O)Nc2cnccc2C)cc1

View on Fragalysis x10248

TRY-UNI-2eddb1ff-1

Cc1ccncc1NC(=O)Cc1cncc(C#N)c1

View on Fragalysis x10314

RAL-MED-2de63afb-2

Cc1cc(NC(=O)Cc2cncnc2)cc(OC2CC(=O)N2)c1

View on Fragalysis x10322

JAG-UCB-a3ef7265-20

O=C(Nc1nncn1C1CC1)C1CCOc2ccc(Cl)cc21

View on Fragalysis x10324

JAN-GHE-83b26c96-9

Cc1ccncc1NC(=O)C(c1cccc(Cl)c1)C(C)C

View on Fragalysis x10327

JAN-GHE-83b26c96-1

CCC(C(=O)Nc1cnncc1C)c1cccc(Cl)c1

View on Fragalysis x10329

EDJ-MED-49816e9b-2

Cc1ccnc(C)c1NC(=O)Cc1cccc(Cl)c1

View on Fragalysis x10334

MAT-POS-590ac91e-32

COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2cc(F)ccc12

View on Fragalysis x10355

ALP-POS-95b75b4d-2

Cc1ccncc1NC(=O)Cc1cccc(O)c1

View on Fragalysis x10359

RAL-MED-2de63afb-1

O=C(Cc1cccnc1)Nc1cccc(OC2CC(=O)N2)c1

View on Fragalysis x10371

JAN-GHE-83b26c96-3

CC(C(=O)Nc1cnccc1-n1cccn1)c1cccc(Cl)c1

View on Fragalysis x10377

RAL-MED-2de63afb-14

O=C(Cc1cncnc1)Nc1cc(F)cc(OC2CC(=O)N2)c1

View on Fragalysis x10387

JAN-GHE-83b26c96-20

Cc1ccncc1NC(=O)C1(c2cccc(Cl)c2)CC1

View on Fragalysis x10392

JAN-GHE-83b26c96-10

Cc1ccncc1NC(=O)C(c1cccc(Cl)c1)N(C)C

View on Fragalysis x10395

JAN-GHE-83b26c96-23

Cc1ccncc1NC(=O)C(F)(F)c1cccc(Cl)c1

View on Fragalysis x10396

BEN-DND-7e92b6ca-4

O=C(NCCNc1ccccc1)c1cc(=O)[nH]c2ccccc12

View on Fragalysis x10403

ALP-POS-95b75b4d-1

Cc1ccncc1NC(=O)Cc1cccc(F)c1

View on Fragalysis x10417

BEN-DND-7e92b6ca-2

COc1ccccc1OCCN(C)C(=O)c1cc(=O)[nH]c2ccccc12

View on Fragalysis x10419

ADA-UNI-f8e79267-5

CNCCC(C(=O)Nc1cccnc1)c1ccccc1

View on Fragalysis x10421

JAN-GHE-83b26c96-22

Cc1ccncc1NC(=O)C(C)(C)c1cccc(Cl)c1

View on Fragalysis x10422

JAN-GHE-83b26c96-8

CCCC(C(=O)Nc1cnccc1C)c1cccc(Cl)c1

View on Fragalysis x10423

JAN-GHE-5a013bed-2

O=C(Cc1cccc(Cl)c1)Nn1cnc2ccccc21

View on Fragalysis x10466

MAT-POS-590ac91e-5

Cc1ccncc1NC(=O)C(C)CC1CC1

View on Fragalysis x10473

MAT-POS-590ac91e-11

Cc1ccncc1NC(=O)CC(C)C(C)C

View on Fragalysis x10474

MAT-POS-590ac91e-21

Cc1ccncc1NC(=O)C1CCC2(CC2)C1

View on Fragalysis x10476

MAT-POS-590ac91e-25

Cc1ccncc1NC(=O)CC12CCCC1C2

View on Fragalysis x10478

BEN-DND-93268d01-13

Cc1ccncc1NC(=O)CC(C)(C)c1ccccc1

View on Fragalysis x10484

EDG-MED-0da5ad92-18

Cc1ccnc(N)c1NC(=O)Cc1cccc(Cl)c1

View on Fragalysis x10494

DUN-NEW-f8ce3686-24

CC(=O)NCCc1c[nH]c2c(CN3CCN(C(=O)CCl)CC3)cccc12

View on Fragalysis x10506

NIR-THE-c331be7a-6

Cc1cccc(C2CN(C(=O)CCl)Cc3ccccc32)c1

View on Fragalysis x10513

MAT-POS-590ac91e-39

COc1ccccc1OC(C)CNC(=O)c1cc(=O)[nH]c2ccc(F)cc12

View on Fragalysis x10525

MAT-POS-590ac91e-22

Cc1ccncc1NC(=O)C1CCC12CCC2

View on Fragalysis x10555

MAT-POS-590ac91e-18

Cc1ccncc1NC(=O)C1CC(C2CC2)C1

View on Fragalysis x10559

JAN-GHE-83b26c96-13

Cc1ccncc1NC(=O)Cc1cccc(I)c1

View on Fragalysis x10565

ALP-POS-95b75b4d-4

Cc1ccncc1NC(=O)Cc1cccc(C2CC2)c1

View on Fragalysis x10566

MAT-POS-590ac91e-23

Cc1ccncc1NC(=O)CC1CC2CC2C1

View on Fragalysis x10575

BEN-DND-93268d01-7

Cc1ccncc1NC(=O)CCc1ccccc1F

View on Fragalysis x10598

JAN-GHE-5a013bed-4

O=C(Cc1cccc(Cl)c1)Nn1cn[nH]c1=O

View on Fragalysis x10604

JAN-GHE-83b26c96-21

Cc1ccncc1NS(=O)(=O)c1cccc(Cl)c1

View on Fragalysis x10606

MAT-POS-590ac91e-27

Cc1ccncc1NC(=O)C1(C#N)CCOC1

View on Fragalysis x10610

MAT-POS-590ac91e-19

Cc1ccncc1NC(=O)[C@@H]1[C@H]2CCCC[C@H]21

View on Fragalysis x10626

BAR-COM-0f94fc3d-48

Cc1ccncc1NC(=O)CN1C(=O)COc2ccc(Cl)cc21

View on Fragalysis x10638

BAR-COM-0f94fc3d-59

CC(=O)Nc1ccncc1NC(=O)C1Cc2ccc(F)cc21

View on Fragalysis x10645

NIR-THE-c331be7a-2

N#Cc1cccc(C2CN(C(=O)CCl)Cc3ccccc32)c1

View on Fragalysis x10678

BAR-COM-0f94fc3d-41

Cc1ccncc1NC(=O)Cn1ccc2ccc(Cl)cc21

View on Fragalysis x10679

BEN-DND-7e92b6ca-1

COc1ccccc1OCCNC(=O)c1cc[nH]c(=O)c1

View on Fragalysis x10700

TRY-UNI-2eddb1ff-2

Cc1ccncc1NC(=O)Cc1cncc(Cl)c1

View on Fragalysis x10723

WAR-XCH-72a8c209-5

O=C(CCl)N1CCCC(N(CC2CCCCC2)C2CCC(O)CC2)C1

View on Fragalysis x10728

BAR-COM-0f94fc3d-18

Cc1ccncc1NC(=O)Cn1ccc2ccc(F)cc21

View on Fragalysis x10733

BRU-LEF-c49414a7-1

Cc1ccncc1NC(=O)Cc1cccc(OC2CC(=O)N2)c1

View on Fragalysis x10756

BAR-COM-0f94fc3d-25

Cc1ccncc1NC(=O)C1(c2cccc(Cl)c2)CC(=O)C1

View on Fragalysis x10787

TRY-UNI-2eddb1ff-7

Cc1ccncc1NC(=O)Cc1cc(Cl)cc(OC2CC(=O)N2)c1

View on Fragalysis x10789

NAU-LAT-445f63e5-6

O=C(Nc1cccnc1)NC1(Cc2ccccc2)CCOCC1

View on Fragalysis x10800

MAT-POS-590ac91e-24

Cc1ccncc1NC(=O)CC1CC2(CC2)C1

View on Fragalysis x10801

ALP-POS-c59291d4-5

O=C(Oc1cncc(Cl)c1)c1cccc2[nH]ccc12

View on Fragalysis x10812

ALP-POS-c59291d4-4

CNc1ccc(N(Cc2ccsc2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x10820

BAR-COM-0f94fc3d-23

COc1ccncc1NC(=O)C(O)c1cccc(Br)c1

View on Fragalysis x10834

BAR-COM-0f94fc3d-58

COc1ccc(Br)cc1C(N)C(=O)Nc1cnccc1C

View on Fragalysis x10856

BAR-COM-0f94fc3d-3

COCC(NC(=O)CC1C(=O)Nc2ccc(F)cc21)c1cccc(Br)c1

View on Fragalysis x10862

ALP-POS-c59291d4-3

O=C(Nc1ccc(N(Cc2ccsc2)C(=O)Cn2nnc3ccccc32)cc1)C1CC1

View on Fragalysis x10870

ALP-POS-c59291d4-2

CCC(=O)Nc1ccc(N(Cc2ccsc2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x10871

ALP-POS-d2866bdf-1

CN(C)c1ccc(N(Cc2ccsc2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x10876

BAR-COM-0f94fc3d-38

CCC(O)(C(=O)Nc1cnccc1C)c1cccc(Cl)c1

View on Fragalysis x10888

ADA-UNI-f8e79267-2

CS(=O)(=O)NCCC(C(=O)Nc1cccnc1)c1ccccc1

View on Fragalysis x10889

JAG-UCB-119787ef-1

O=C(Nc1nncn1C1CC1)[C@@H]1CCOc2ccc(Cl)cc21

View on Fragalysis x10898

DUN-NEW-f8ce3686-23

O=C(CCl)Nc1nc2c(S(=O)(=O)NCCc3ccccc3)cccc2s1

View on Fragalysis x10899

TRY-UNI-2eddb1ff-3

Cc1ccncc1NC(=O)C(C)c1cncc(Cl)c1

View on Fragalysis x10900

MAT-POS-968e8d9c-1

O=C(Nc1nncn1C1CC1)[C@H]1CCOc2ccc(Cl)cc21

View on Fragalysis x10906

LON-WEI-0a73fcb8-7

O=C(Nc1cnccc1CO)C1CCOc2ccc(Cl)cc21

View on Fragalysis x10942

ADA-UCB-6c2cb422-1

O=C(Cc1cccc(Cl)c1)Nc1cncc2ccccc12

View on Fragalysis x10959

EDG-MED-0da5ad92-12

Cc1cncc(NC(=O)Cc2cccc(Cl)c2)c1

View on Fragalysis x10976

JAG-UCB-a3ef7265-23

CCc1ccncc1NC(=O)Cc1cccc(C(F)(F)F)n1

View on Fragalysis x10995

DAR-DIA-23aa0b97-14

O=C(Nc1cccnc1)Nc1cccc(Cl)c1

View on Fragalysis x10996

EDJ-MED-49816e9b-1

Cc1ccncc1CC(=O)Nc1cccc(Cl)c1

View on Fragalysis x11011

EDG-MED-0da5ad92-16

Cc1cnncc1NC(=O)Cc1cccc(Cl)c1

View on Fragalysis x11013

EDG-MED-0da5ad92-21

Cc1[nH]ncc1NC(=O)Cc1cccc(Cl)c1

View on Fragalysis x11025

JAN-GHE-83b26c96-15

Cc1ccncc1N(C)C(=O)Cc1cccc(Cl)c1

View on Fragalysis x11041

TRY-UNI-714a760b-16

Cc1ccncc1NC(=O)C(C)C1CCCCC1

View on Fragalysis x11044

EDJ-MED-0e996074-1

O=C(Nc1nncn1C1CC1)C1CCOc2ccccc21

View on Fragalysis x11159

ALP-POS-c0c213c9-14

Cn1ccc(CN(C(=O)Cc2cccnc2)c2ccc(-c3ccccn3)cc2)n1

View on Fragalysis x11164

NAU-LAT-8502cac5-2

O=C(Nc1nncn1C1CC1)C1COc2ccc(Cl)cc21

View on Fragalysis x11186

PET-SGC-a8a902d9-1

Cc1ccncc1NC(=O)CC(c1ccsc1)N1CCC(O)CC1

View on Fragalysis x11225

NAU-LAT-8502cac5-6

O=C(Nc1nncn1-c1ccccc1)C1COc2ccc(Cl)cc21

View on Fragalysis x11231

BRU-THA-a358fbdd-2

CC1(C(=O)Nc2nncn2C2CC2)CCOc2ccccc21

View on Fragalysis x11233

MAT-POS-c9973a83-1

COc1cc(Cl)cc(CC(=O)Nc2cnccc2C)c1

View on Fragalysis x11271

EDJ-MED-6af13d92-2

COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2cccc(F)c12

View on Fragalysis x11276

EDJ-MED-6af13d92-3

COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2cccc(OC)c12

View on Fragalysis x11294

EDJ-MED-6af13d92-1

COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2cccc(C)c12

View on Fragalysis x11313

TRY-UNI-714a760b-3

Cc1c(N)cncc1NC(=O)Cc1cccc(Cl)c1

View on Fragalysis x11317

TRY-UNI-714a760b-19

Cc1c(N)cncc1NC(=O)Cc1cccc(C#N)c1

View on Fragalysis x11318

ERI-UCB-5b47150d-6

Cc1ccncc1NC(=O)[C@@H]1C[C@H]1CF

View on Fragalysis x11339

JAG-UCB-a3ef7265-18

Cc1cc(C)cc(CC(=O)Nc2nncn2C)c1

View on Fragalysis x11346

ADA-UCB-6c2cb422-3

Cc1ccncc1CC(=O)Nc1cccc2c1CNCC2

View on Fragalysis x11354

BEN-DND-7e92b6ca-16

O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2ccccc2F)CC1

View on Fragalysis x11366

JAN-GHE-83b26c96-12

Cc1ccncc1NC(=O)Cc1cccc(Br)c1

View on Fragalysis x11368

JAN-GHE-83b26c96-2

CC(=O)Nc1ccncc1NC(=O)C(C)c1cccc(Cl)c1

View on Fragalysis x11372

BEN-DND-93268d01-8

CC(=O)N1CCN(CC(=O)Nc2cnccc2C)CC1

View on Fragalysis x11417

VLA-UCB-00f2c2b3-7

O=C(Cc1cccc(Cl)c1)Nc1cccc2[nH]ncc12

View on Fragalysis x11424

MAT-POS-6da3605a-2

OC(Cc1cccc(Cl)c1)Cn1cncn1

View on Fragalysis x11426

BEN-DND-93268d01-6

Cc1ccncc1NC(=O)CCc1cccc(F)c1

View on Fragalysis x11427

BEN-DND-93268d01-11

Cc1ccncc1NC(=O)CN1CCCCC1

View on Fragalysis x11428

EDJ-MED-a364e151-1

O=C(Cc1cccc(Cl)c1)Nc1cncc2c1CCCC2

View on Fragalysis x11431

EDJ-MED-06d94977-2

CN(Cc1cccc(Cl)c1)C(=O)Cn1nnc2ccccc21

View on Fragalysis x11432

PET-UNK-8df914d1-2

O=C(Cc1cccc(Cl)c1)Nc1cnc2ccccn12

View on Fragalysis x11454

PET-UNK-c9c1e0d8-2

C#Cc1cccc(CC(=O)Nc2cncc3ccccc23)c1

View on Fragalysis x11458

PET-UNK-8df914d1-4

Cn1cncc1NC(=O)Cc1cccc(Cl)c1

View on Fragalysis x11473

JAG-UCB-cedd89ab-1

Cc1ccncc1N1CCN(c2cccc(Cl)c2)C1=O

View on Fragalysis x11475

EDG-MED-0da5ad92-15

Cc1ccnnc1NC(=O)Cc1cccc(Cl)c1

View on Fragalysis x11485

MAT-POS-1e5f28a7-1

COC(=O)C(C(=O)Nc1cnccc1C)c1cccc(Cl)c1

View on Fragalysis x11488

EDJ-MED-50fe53e8-3

O=C(Cc1cccc(Cl)c1)Nc1ncn2ccccc12

View on Fragalysis x11493

VLA-UCB-1dbca3b4-15

O=C(Nc1cncc2ccccc12)C1CCOc2ccc(Cl)cc21

View on Fragalysis x11498

MAT-POS-f7918075-5

O=C(Cc1cccc(Cl)c1)Nc1cncc2ccncc12

View on Fragalysis x11499

MAT-POS-bb423b95-7

CN(C(=O)Cc1cccc(Cl)c1)c1cncc2ccccc12

View on Fragalysis x11501

ALP-POS-0c2c77e1-1

O=C(Cc1cccc(Cl)c1)Nc1cnccc1-c1ccccc1

View on Fragalysis x11507

EDJ-MED-50fe53e8-1

O=C(Cc1cccc(Cl)c1)Nc1nncc2ccccc12

View on Fragalysis x11508

ALP-POS-f13221e1-4

Cc1ccncc1NC(=O)CCc1cccc(Cl)c1

View on Fragalysis x11513

MAT-POS-bb423b95-2

O=C(Cc1cccc(Cl)c1)Nc1cncc2cccnc12

View on Fragalysis x11530

MIC-UNK-66895286-1

O=C(Cc1cccc(Cl)c1)Nc1cn[nH]c1

View on Fragalysis x11532

MIC-UNK-66895286-3

Cc1[nH]ncc1CC(=O)Nc1cccc(Cl)c1

View on Fragalysis x11540

ALP-POS-6747fa38-1

CC(=O)N1CCN(CC(=O)Nc2cncc3ccccc23)CC1

View on Fragalysis x11541

MAT-POS-bb423b95-1

O=C(Cc1cccc(Cl)c1)Nc1cncc2cnccc12

View on Fragalysis x11542

ALP-POS-95b75b4d-5

O=C(Cc1cccc(Cl)c1)Nc1cnccc1C1CC1

View on Fragalysis x11543

MIC-UNK-08cd9c58-1

O=C(Cc1cccc(Cl)c1)Nc1cncc2ncccc12

View on Fragalysis x11548

EDG-MED-0da5ad92-5

Cc1ccncc1NC(=O)C(CO)c1cccc(Cl)c1

View on Fragalysis x11557

MAT-POS-590ac91e-16

Cc1ccncc1NC(=O)[C@H](C)OC(F)F

View on Fragalysis x11560

EDG-MED-0da5ad92-7

CCCCOc1ccc(Cl)cc1CC(=O)Nc1cnccc1C

View on Fragalysis x11562

MAT-POS-f42f3716-6

Cc1ccncc1NC(=O)Cc1cc(Cl)cc(-c2ccc(C)c(F)c2F)c1

View on Fragalysis x11564

TAT-ENA-80bfd3e5-7

CSC1=C(C#N)C2(CCCCC2)C(C#N)=C(NC(=O)CCl)N1

View on Fragalysis x11579

TAT-ENA-80bfd3e5-37

Cc1cc(C(=O)CCl)c(C)n1NC(=O)c1n[nH]c(=O)c2ccccc12

View on Fragalysis x11587

TAT-ENA-80bfd3e5-4

Cc1c(C(=O)CCl)c2ccccn2c1C(=O)c1ccc(F)cc1

View on Fragalysis x11590

MAT-POS-3b92565d-1

COc1ccc(Cl)cc1CC(=O)Nc1cncc2ccccc12

View on Fragalysis x11609

MAT-POS-b3e365b9-1

O=C(Nc1cncc2ccccc12)[C@@H]1CCOc2ccc(Cl)cc21

View on Fragalysis x11612

ERI-UCB-a0b0dbcb-4

O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2cccc(C(F)(F)F)c2)CC1

View on Fragalysis x11616

TRY-UNI-2eddb1ff-8

Cc1ccncc1NC(=O)C(C)c1cc(Cl)cc(OC2CC(=O)N2)c1

View on Fragalysis x11641

MAT-POS-6344a35d-1

COc1cccc(Oc2cc(Cl)cc(NC(=O)Cc3cncc4ccccc34)c2)n1

View on Fragalysis x11642

MAT-POS-5d20d11c-1

Cc1ccncc1NC(=O)[C@@H](C)OC(F)F

View on Fragalysis x11708

CHO-MSK-6e55470f-5

Cc1noc(COc2cc(Cl)cc(CC(=O)Nc3cnccc3C)c2)n1

View on Fragalysis x11723

MAT-POS-f7918075-8

O=C(Cc1cccc(Cl)c1)Nc1cncc2nc[nH]c12

View on Fragalysis x11742

WIL-MOD-03b86a88-6

Cc1ccncc1NC(=O)Cc1cc(Cl)cc(NS(N)(=O)=O)c1

View on Fragalysis x11743

ALP-POS-c0c213c9-1

COc1ccc2nnn(CC(=O)N(Cc3ccccn3)c3ccc(C4CCNCC4)cc3)c2c1

View on Fragalysis x11757

MAT-POS-044491d2-1

Cc1ccncc1NC(=O)Cc1cc(Cl)cc(NC2CCCC2O)c1

View on Fragalysis x11764

MAT-POS-bfb445d4-2

O=C(Cc1cccc(Cl)c1)Nn1nnc2ccccc21

View on Fragalysis x11789

PET-UNK-1901c25b-1

CN(C)c1ccc(N(Cc2ccsc2)C(=O)Cc2cncc3ccccc23)cc1

View on Fragalysis x11790

PET-UNK-7374c256-2

CN(C)c1ccc(N(Cc2ccn[nH]2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x11797

ROB-IMP-e811baff-1

CNC(=O)Nc1ccc(N(Cc2ccsc2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x11798

RAL-THA-6b94ceba-5

CC(=O)NCc1cc(Cl)cc(CC(=O)Nc2cnccc2C)c1

View on Fragalysis x11801

MAT-POS-b3e365b9-4

Cc1ccncc1NC(=O)[C@@H]1CCOc2ccc(Cl)cc21

View on Fragalysis x11809

PET-UNK-3c72d439-1

O=C(Cc1cc(Cl)ccn1)Nc1cncc2ccccc12

View on Fragalysis x11810

MAR-UCB-f313ec4d-6

O=C(c1cncc2ccccc12)N1CCN(c2ccccc2)CC1

View on Fragalysis x11812

MAR-UCB-f313ec4d-2

COc1ccccc1OCCNC(=O)c1cncc2ccccc12

View on Fragalysis x11813

MAT-POS-bbbbc21a-3

O=C(Cc1cc(Cl)cc2c1OCC2)Nc1cncc2ccccc12

View on Fragalysis x11831

MAT-POS-2db6411e-2

O=C(CCl)N1CCN(Cc2cc(O)cc(Cl)c2)CC1

View on Fragalysis x11852

MAT-POS-199e2e7c-1

O=C(Cc1cccc(Cl)c1)Nc1cncc2c1CCC2

View on Fragalysis x12000

ERI-UCB-a0b0dbcb-8

COc1ccccc1NC1CN(C(=O)c2cc(=O)[nH]c3ccccc23)C1

View on Fragalysis x12025

PET-UNK-e44ffd04-1

O=C(Cc1cccc(Cl)c1)Nc1nnc2ccccn12

View on Fragalysis x12026

ERI-UCB-a0b0dbcb-9

COc1ccccc1OC1CN(C(=O)c2cc(=O)[nH]c3ccccc23)C1

View on Fragalysis x12064

MAT-POS-8a69d52e-7

C[C@@H]1COc2ccc(Cl)cc2[C@@H]1C(=O)Nc1cncc2ccccc12

View on Fragalysis x12073

JAG-UCB-52b62a6f-11

Cc1ccn2cnnc2c1NC(=O)C1CCOc2ccc(Cl)cc21

View on Fragalysis x12136

ALP-POS-87c86d55-1

CN(C)c1ccc(N(Cc2cscn2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x12143

ALP-POS-477dc5b7-2

O=C(Nc1cncc2ccccc12)C1CCNc2ccc(Cl)cc21

View on Fragalysis x12171

CHO-MSK-00c5269a-2

COc1ccc(N(Cc2cccc(Cl)c2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x12177

ALP-POS-cd485364-2

Nc1cncc2c1CCCN2C(=O)Cc1cccc(Cl)c1

View on Fragalysis x12202

ANT-DIA-62e4526e-1

CC1CCN(C(=O)Cn2nnc3ccccc32)CC1

View on Fragalysis x12204

EDJ-MED-e4b030d8-13

C[C@@]1(C(=O)Nc2cncc3ccccc23)CCOc2ccc(Cl)cc21

View on Fragalysis x12207

MAT-POS-044491d2-7

Cc1ccncc1NC(=O)Cc1cc(Cl)cc(NCC(C)(C)C#N)c1

View on Fragalysis x12300

MAT-POS-044491d2-3

Cc1ccncc1NC(=O)Cc1cc(Cl)cc(NC2CC2C(F)(F)F)c1

View on Fragalysis x12321

MAT-POS-b5746674-38

CC(C)OCCCN(Cc1ccco1)C(=O)Nc1cn(C)c(=O)c2ccccc12

View on Fragalysis x12350

ALP-POS-6d04362c-1

CN(C)c1ccc(N(Cc2ccccc2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x12419

ALP-POS-6d04362c-2

CN(C)c1ccc(N(Cc2cccc(Cl)c2)C(=O)Cn2nnc3ccccc32)cc1

View on Fragalysis x12423

Literature SARS-COV-2 Structures

PDB ID: 6LZE

O=C[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cc2ccccc2[nH]1

View on RCSB PDB 6LZE

PDB ID: 6M0K

O=C[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](Cc1cccc(F)c1)NC(=O)c1cc2ccccc2[nH]1

View on RCSB PDB 6M0K

PDB ID: 6M2N

O=c1cc(-c2ccccc2)oc2cc(O)c(O)c(O)c12

View on RCSB PDB 6M2N

PDB ID: 6Y2G

CC(C)(C)OC(=O)Nc1cccn([C@@H](CC2CC2)C(=O)N[C@@H](C[C@@H]2CCNC2=O)C(=O)C(=O)NCc2ccccc2)c1=O

View on RCSB PDB 6Y2G

PDB ID: 6Y2F

CC(C)(C)OC(=O)Nc1cccn([C@@H](CC2CC2)C(=O)N[C@@H](C[C@@H]2CCNC2=O)C(=O)C(=O)NCc2ccccc2)c1=O

View on RCSB PDB 6Y2F

PDB ID: 6WNP

CC(C)(C)NC(=O)N[C@H](C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)NC(CC1CCC1)C(=O)C(N)=O)C2(C)C)C(C)(C)C

View on RCSB PDB 6WNP

PDB ID: 7BUY

CCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O

View on RCSB PDB 7BUY

PDB ID: 6YT8

c1cc[n+]2c(c1)S[Zn-2]1(O2)O[n+]2ccccc2S1

View on RCSB PDB 6YT8

PDB ID: 6W63

CC(C)(C)c1ccc(N(C(=O)c2c[nH]cn2)[C@@H](C(=O)NC2CCCCC2)c2cccnc2)cc1

View on RCSB PDB 6W63

PDB ID: 6LU7

$Cc1cc(C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](/C=C\C(=O)OCc2ccccc2)C[C@H]2CCNC2=O)C(C)C)no1$

View on RCSB PDB 6LU7

PDB ID: 7BQY

$Cc1cc(C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](/C=C\C(=O)OCc2ccccc2)C[C@H]2CCNC2=O)C(C)C)no1$

View on RCSB PDB 7BQY

PDB ID: 6Y7M

CC(C)(C)OC(=O)Nc1cccn([C@@H](CC2CCCCC2)C(=O)N[C@@H](C[C@@H]2CCNC2=O)C(=O)C(=O)NC2CC2)c1=O

View on RCSB PDB 6Y7M

Literature SARS-COV-1 Structures

PDB ID: 2GZ7

Cc1cc(S(=O)(=O)c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])c(Cl)cc1Cl

View on RCSB PDB 2GZ7

PDB ID: 2GZ8

O=C(Sc1nnc(C(F)(F)F)[nH]1)c1ccc(C#Cc2ccccc2)o1

View on RCSB PDB 2GZ8

PDB ID: 4MDS

CCC(C)(C)NC(=O)[C@@H](c1cccn1C)N(C(=O)Cn1nnc2ccccc21)c1ccc(NC(C)=O)cc1

View on RCSB PDB 4MDS

PDB ID: 3V3M

CC(C)(C)NC(=O)[C@@H](c1cccnc1)N(C(=O)c1ccco1)c1ccc(C(C)(C)C)cc1

View on RCSB PDB 3V3M

PDB ID: 1UK4

Cbz-Val-Asn-Ser-Thr-Leu-Gln-CMK

View on RCSB PDB 1UK4

PDB ID: 2AMD

$CCOC(=O)/C=C\[C@@H](C[C@@H]1CCNC1=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)c1ccoc1)C(C)C)C(C)C$

View on RCSB PDB 2AMD

PDB ID: 2ALV

CCOC(=O)/C=C/[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](CC=C(C)C)CC(=O)[C@@H](NC(=O)c1cc(C)on1)C(C)C

View on RCSB PDB 2ALV

PDB ID: 2A5I

CCOC(=O)[C@@H]1O[C@H]1C(=O)N(CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1

View on RCSB PDB 2A5I

PDB ID: 2GX4

C[C@@H](OC(C)(C)C)[C@H](NC(=O)OCc1ccccc1)C(=O)N([C@H](CO)C[C@@H]1CCNC1=O)[C@@H](CC1CCCCC1)C(N)=O

View on RCSB PDB 2GX4

PDB ID: 2GTB

CCOC(=O)[C@@H]1O[C@H]1C(=O)N(CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1

View on RCSB PDB 2GTB

PDB ID: 2HOB

$Cc1cc(C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](/C=C\C(=O)OCc2ccccc2)C[C@H]2CCNC2=O)C(C)C)no1$

View on RCSB PDB 2HOB

PDB ID: 2OP9

C[C@H](C(=O)CCO)N(C(=O)OCc1ccccc1)[C@@H](Cc1ccccc1)C(N)=O

View on RCSB PDB 2OP9

PDB ID: 2Z3C

CC(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@@H](CC(C)C)C(N)=O)[C@H](C[C@H]1CCNC1=O)[C@@H](C)O)[C@@H](C)OCc1ccccc1)C(C)C

View on RCSB PDB 2Z3C

PDB ID: 2V6N

CN(C)c1ccc(C(=O)On2nnc3ccccc32)cc1

View on RCSB PDB 2V6N

PDB ID: 3AVZ

ACE-SER-ALA-VAL-ALC-HIS-H

View on RCSB PDB 3AVZ

PDB ID: 2VJ1

O=C(On1nnc2ccccc21)c1ccccc1

View on RCSB PDB 2VJ1

Other Relevant Literature Structures

PDB ID: 4YOI

O=C(Nc1ccc(N(Cc2ccsc2)C(=O)Cn2nnc3ccccc32)cc1)c1cccs1

View on RCSB PDB 4YOI

PDB ID: 4YOG

CC(=O)Nc1ccc(N(C(=O)Cn2nnc3ccccc32)[C@@H](C(=O)NC(C)(C)C)c2ccsc2)cc1

View on RCSB PDB 4YOG