Molecule Details

O=C(Cc1ccc(Cl)s1)Nc1cccnc1
3-aminopyridine-like Enamine Mcule MolPort Assayed
View on Fragalysis x2643
Molecular Properties
SMILES:
O=C(Cc1ccc(Cl)s1)Nc1cccnc1
MW: 252.726
Fraction sp3: 0.09
HBA: 3
HBD: 1
Rotatable Bonds: 3
TPSA: 41.99
cLogP: 2.9777
Covalent Warhead:
Covalent Fragment:
Source
Enamine SCR: Z2010253653
Enamine REAL: Z2010253653
Enamine Extended REAL: s_22____57778____9869024
Mcule: MCULE-7730773676
Mcule Ultimate: VLAXFSPPTLAYDD-UHFFFAOYSA-N
MolPort: MolPort-047-311-544
Activity Data
Average Inhibition @ 20 µM - Fluorescence: 0.92202215
Average Inhibition @ 50 µM - Fluorescence: 11.50041
Relative Solubility @ 20 µM: 1.0
Relative Solubility @ 100 µM: 1.0
Order Status
Ordered: 2020-03-31
Synthesis Location: enamine
Shipped: 2020-04-09
Cc1ccc(CC(=O)Nc2cccnc2)s1

DAR-DIA-842b4336-12
0.679

View
N#Cc1ccc(CC(=O)Nc2cccnc2)s1

DAR-DIA-842b4336-14
0.644

View
O=C(Cc1ccc(Cl)cc1)Nc1cccnc1

MAK-UNK-a7b37c5e-4
0.552

View
O=C(Cc1ccccc1Cl)Nc1cccnc1

MAK-UNK-a7b37c5e-1
0.550

View
O=C(CCl)Nc1cccnc1

MAK-UNK-ca11b4f7-1
0.528

View
O=C(Cc1cncc(Cl)c1)Nc1cccnc1

DAR-DIA-23aa0b97-16
0.525

View
O=C(CC(=O)Nc1cccnc1)Nc1cccnc1

MAR-TRE-67513f76-81
0.519

View
O=C(Cc1ccccc1)Nc1cccnc1

SAN-PRS-52b81272-2
0.517

View
O=C(Cc1cccc(Cl)c1)Nc1cccnc1

EDG-MED-0da5ad92-2
0.516

View
Cc1nnc(CC(=O)Nc2cccnc2)s1

ALE-HEI-f28a35b5-5
0.516

View
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)Nc1cccnc1

MAR-TRE-2fd8122f-94
0.514

View
O=C(Cc1cncnc1)Nc1cccnc1

SAD-SAT-24589cd1-4
0.508

View
O=C(Cc1ccsc1)Nc1cccnc1

DAR-DIA-842b4336-10
0.508

View
O=C(Nc1cccnc1)Nc1ccc(Cl)s1

DAR-DIA-842b4336-4
0.492

View
O=C(Cc1ccc(F)cc1)Nc1cccnc1

MAK-UNK-a7b37c5e-5
0.492

View
Cc1cnc(CC(=O)Nc2cccnc2)o1

DAR-DIA-842b4336-16
0.484

View
Cn1cc(CC(=O)Nc2cccnc2)cn1

DAR-DIA-842b4336-11
0.469

View
O=C(Cc1ccccc1C(=O)O)Nc1cccnc1

MAK-UNK-a7b37c5e-2
0.462

View
N#Cc1cnc(CC(=O)Nc2cccnc2)o1

DAR-DIA-842b4336-15
0.456

View
O=C(CCCBr)Nc1cccnc1

ALE-HEI-f28a35b5-14
0.450

View
NS(=O)(=O)c1cccc(CC(=O)Nc2cccnc2)c1

CHA-MCP-85291e1d-2
0.449

View
Cc1cn(C)c(CC(=O)Nc2cccnc2)c1C(=O)O

MAR-TRE-67513f76-13
0.437

View
NCCc1nc(CC(=O)Nc2cccnc2)cs1

MAR-TRE-2fd8122f-99
0.437

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

DAR-DIA-23aa0b97-17
0.435

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

ANN-UNI-26382800-5
0.435

View
O=C(Cc1c[nH]c2ncccc12)Nc1cccnc1

KAL-WAB-eb347ebe-1
0.435

View
O=C(C[S+]([O-])CC(=O)Nc1cccnc1)Nc1ccc(Cl)cc1

MAR-TRE-7f7bb9f0-74
0.433

View
CCn1cc(C)c(C(=O)O)c1CC(=O)Nc1cccnc1

MAR-TRE-9c797165-94
0.431

View
Cn1cc(S(N)(=O)=O)cc1CC(=O)Nc1cccnc1

MAR-TRE-2fd8122f-37
0.431

View
Cc1nn(-c2nc(CC(=O)Nc3cccnc3)cs2)c(C)c1Cl

MAR-TRE-67513f76-69
0.430

View
O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)Nc1cccnc1

SAD-SAT-135344c3-6
0.427

View
NS(=O)(=O)Cc1cccc(CC(=O)Nc2cccnc2)c1

CHA-MCP-85291e1d-5
0.423

View
O=C(CC(c1ccccc1)c1ccccc1)Nc1cccnc1

AUS-ARG-7cfdce8f-11
0.422

View
O=C(Cc1nnc(O)c2ccccc12)Nc1cccnc1

MAR-TRE-74c6519b-55
0.417

View
O=C(Nc1cccnc1)Nc1csc(Cl)c1

MAK-UNK-d1e89583-7
0.415

View
O=C(Nc1cccnc1)c1cccc(Cl)c1

CHR-SOS-7098f804-12
0.415

View
C[C@H](O)CN1CCN(CC(=O)Nc2cccnc2)CC1

MAR-TRE-67513f76-73
0.414

View
C[C@@H](N)[C@@H](C)C(=O)NCC(=O)Nc1cccnc1

MAR-TRE-7f7bb9f0-49
0.412

View
O=C(CC1CCCCC1)Nc1cccnc1

FRA-FAC-9ed5a63a-1
0.409

View
O=C(CC1CCCCC1)Nc1cccnc1

AAR-POS-d2a4d1df-13
0.409

View
O=C(CC1CCCCC1)Nc1cccnc1

ALE-HEI-f28a35b5-9
0.409

View
O=C(NC/C=C/Cl)Nc1cccnc1

MAK-UNK-d1e89583-1
0.406

View
O=C(Nc1cccnc1)Nc1cncc(Cl)c1

DAR-DIA-23aa0b97-15
0.406

View
C[C@@H]1CCCC[C@@H]1CC(=O)Nc1cccnc1

MED-UNK-e6e8ef8a-4
0.406

View
CC(=O)NCCc1cccc(CC(=O)Nc2cccnc2)c1

CHA-MCP-85291e1d-1
0.405

View
C=CC(=O)Nc1cccnc1

MAK-UNK-ca11b4f7-2
0.404

View
CC(=O)C(=O)Nc1cccnc1

MAK-UNK-ca11b4f7-3
0.404

View
O=C(C[C@H]1CCCC[C@H]1O)Nc1cccnc1

MED-UNK-e6e8ef8a-5
0.403

View
CC1(CC(=O)Nc2cccnc2)CCCCC1

MED-UNK-e6e8ef8a-6
0.403

View
O=C(CCC(=O)Nc1cccnc1)NCc1ccco1

MAR-TRE-67513f76-87
0.403

View
Cc1c(CC(=O)Nc2cccnc2)c(=O)oc2cc(O)c(Cl)cc12

MAR-TRE-b77b7921-39
0.402

View
CS(=O)(=O)Cc1ccc(C(=O)Nc2cccnc2)o1

ANT-DIA-3c79be55-4
0.400

View
O=C(Nc1ccccc1)Nc1cccnc1

AAR-POS-d2a4d1df-11
0.400

View
COc1cccc(-c2cc(CC(=O)Nc3cccnc3)no2)c1

MAR-TRE-3e4e6814-79
0.400

View
O=C(NCc1cscc1Cl)Nc1cccnc1

MAK-UNK-d1e89583-3
0.400

View
CCc1ccc2oc(Br)c(CC(=O)Nc3cccnc3)c2c1

MAR-TRE-f6f5f473-95
0.397

View
O=C(CNC(=O)c1ccco1)NCC(=O)Nc1cccnc1

MAR-TRE-2fd8122f-60
0.397

View
C[C@H]1CC[C@H](CC(=O)Nc2cccnc2)CC1

MED-UNK-e6e8ef8a-3
0.397

View
O=C(CC1CCC(F)CC1)Nc1cccnc1

FRA-FAC-9ed5a63a-2
0.397

View
O=C(C[C@H]1CC[C@@H](F)CC1)Nc1cccnc1

MED-UNK-e6e8ef8a-2
0.397

View
O=C(Cc1csc(NC(=O)c2ccc(Br)o2)n1)Nc1cccnc1

MAR-TRE-2fd8122f-23
0.395

View
CS(=O)(=O)N(CC(=O)Nc1cccnc1)c1cc(Cl)c(Cl)cc1Cl

KEI-TRE-d5e2018a-89
0.395

View
O=C(NCc1cc(Cl)cs1)Nc1cccnc1

MAK-UNK-d1e89583-9
0.394

View
NC(=O)NC(=O)Cc1ccc(NC(=O)Nc2cccnc2)cc1

WIL-UNI-5578df48-15
0.394

View
N=C(Nc1cccnc1)Nc1csc(Cl)c1

ISA-SCH-8e98219b-4
0.394

View
Cc1cc(C)n(-c2nc(CC(=O)Nc3cccnc3)cs2)n1

MAR-TRE-67513f76-22
0.392

View
O=C(CC1(c2cccnc2)CCCC1)Nc1cccnc1

CHR-SOS-f7373dd1-5
0.391

View
O=C(Nc1cccnc1)Nc1cc(Cl)cc(Cl)c1

WAR-XCH-eb7b662f-3
0.391

View
O=C(Nc1cccnc1)Nc1ccsc1Cl

MAK-UNK-d1e89583-2
0.388

View
O=C(Cc1csc(NC(=O)c2ccsc2)n1)Nc1cccnc1

MAR-TRE-4b834d9a-59
0.388

View
Cc1ncc(C2(CC(=O)Nc3cccnc3)CCCC2)s1

CHR-SOS-f7373dd1-6
0.387

View
O=C(NCc1sccc1Cl)Nc1cccnc1

MAK-UNK-d1e89583-5
0.386

View
O=C(C[S+]([O-])CC(=O)Nc1cccnc1)Nc1ccc(F)cc1

MAR-TRE-7f7bb9f0-56
0.386

View
CC(C)(C)[C@@H](N)C(=O)NCC(=O)Nc1cccnc1

MAR-TRE-67513f76-93
0.386

View
O=C(CC1(CC(=O)Nc2nccs2)CCCCC1)Nc1cccnc1

MAR-TRE-2fd8122f-32
0.385

View
Cc1ncc(CC2(CC(=O)Nc3cccnc3)CCCC2)s1

CHR-SOS-59746812-3
0.385

View
O=C1CC(C(=O)Nc2cccnc2)CC(=O)N1

MAR-TRE-2fd8122f-27
0.385

View
Cc1cc(C)n2nc(CC(=O)Nc3cccnc3)nc2n1

MAR-TRE-9c797165-14
0.385

View
O=C(Nc1cccnc1)c1cc(Cl)ccc1-c1ccccc1

CHR-SOS-7098f804-14
0.384

View
Cc1c(CC(=O)Nc2cccnc2)c(=O)oc2cc(O)ccc12

MAR-TRE-04c86cea-41
0.383

View
CS(=O)(=O)N(CC(=O)Nc1cccnc1)c1ccc2c(c1)OCCO2

KEI-TRE-d5e2018a-65
0.383

View
O=C(Nc1cccnc1)Nc1nc(Cl)co1

DAR-DIA-842b4336-8
0.382

View
O=C(CCN1C(=O)c2ccccc2S1(=O)=O)Nc1cccnc1

MAR-TRE-74c6519b-58
0.382

View
O=C(NCCBr)Nc1cccnc1

ALE-HEI-f28a35b5-15
0.381

View
Cc1occc1C(=O)Nc1nc(CC(=O)Nc2cccnc2)cs1

MAR-TRE-2fd8122f-26
0.381

View
O=C(C[C@H](NCc1cccnc1)C(=O)O)Nc1cccnc1

MAR-TRE-d0525fbf-91
0.380

View
O=C(CC1(Oc2ccccc2)CC1)Nc1cccnc1

CHR-SOS-70e4c98a-6
0.380

View
O=C(CC1(c2cccnc2)CCCCC1)Nc1cccnc1

CHR-SOS-f7373dd1-2
0.380

View
C#Cc1cccc(NC(=O)CC(=O)Nc2cccnc2)c1

MAR-TRE-2fd8122f-57
0.380

View
NS(=O)(=O)c1cnn(CC(=O)Nc2cccnc2)c1

MAR-TRE-2fd8122f-78
0.380

View
O=C(Cc1cccc(N2CCCC2=O)c1)Nc1cccnc1

MAR-TRE-2fd8122f-39
0.380

View
Cc1ncc(CC2(CC(=O)Nc3cccnc3)CCCCC2)s1

CHR-SOS-59746812-4
0.380

View
O=C(Nc1cccnc1)Nc1cccc(Cl)c1

DAR-DIA-23aa0b97-14
0.379

View
Cc1ccc(NC(=O)Nc2cccnc2)s1

DAR-DIA-842b4336-3
0.379

View
O=C(Nc1cccnc1)Nc1cccc(Cl)c1

WAR-XCH-eb7b662f-7
0.379

View
O=C(Nc1cccnc1)Nc1cccc(Cl)c1

JOR-UNI-2fc98d0b-7
0.379

View
O=C(Nc1cccnc1)Nc1cccc(Cl)c1

JAN-GHE-83b26c96-19
0.379

View
N[C@@H]1CC[C@@H](C(=O)NCC(=O)Nc2cccnc2)C1

MAR-TRE-74c6519b-91
0.378

View
O=C(Nc1cccnc1)c1cc(Cl)ccc1O

CHR-SOS-7098f804-11
0.377

View
O=C(CCN1C(=O)C2C3CCC(O3)C2C1=O)Nc1cccnc1

MAR-TRE-2fd8122f-72
0.377

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CN=C1

1.000

View
O=C(CC1=CC=C(Cl)S1)NCC(=O)NC1=CC=CN=C1

0.729

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(C(=O)NC2=CC=CN=C2)C=C1

0.726

View
O=C(CC1=CC=C(Cl)S1)NCCC(=O)NC1=CC=CN=C1

0.705

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(C(=O)NC2=CC=CN=C2)C(Cl)=C1

0.682

View
O=C(CC1=CC=C(Br)S1)NC1=CC=CN=C1

0.679

View
CC1=CC=C(CC(=O)NC2=CC=CN=C2)S1

0.679

View
O=C(COC(=O)CC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.651

View
O=C(CCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.644

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(OC2=CC=CN=C2)N=C1

0.642

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(OC2=CC=CN=C2)C=C1

0.641

View
O=C(CC1=CC=C(Cl)S1)NC1=CN=CN=C1

0.625

View
O=C(COC1=CC=CC=C1NC(=O)CC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.625

View
NS(=O)(=O)C1=CC=C(CC(=O)NC2=CC=CN=C2)S1

0.623

View
O=C(CCNCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.619

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CC=C1

0.611

View
CC1=CC=C(NC(=O)CC2=CC=C(Cl)S2)C=N1

0.610

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=NC=C1

0.607

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(Cl)N=C1

0.603

View
O=C(CS(=O)(=O)CC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.594

View
O=C(CCSCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.594

View
CN(CC(=O)NC1=CC=CN=C1)CC1=CC=C(Cl)S1

0.594

View
CN(CCC(=O)NC1=CC=CN=C1)CC1=CC=C(Cl)S1

0.594

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(Br)N=C1

0.593

View
O=C(CC1=CC=CS1)NC1=CC=CN=C1

0.586

View
O=C(CC1=CN=CS1)NC1=CC=CN=C1

0.586

View
O=C(CC1=CC=C(Cl)S1)NCC1=CC=C(C(=O)NC2=CC=CN=C2)C=C1

0.586

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(F)N=C1

0.583

View
O=C(CCC1=CC=C(Cl)S1)NCC(=O)NC1=CC=CN=C1

0.576

View
CCN(CC(=O)NC1=CC=CN=C1)CC1=CC=C(Cl)S1

0.576

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(Cl)C=C1

0.571

View
O=C(CNC(=O)NCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.567

View
O=C(CCNCCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.567

View
O=C(NCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.565

View
O=C(CC1=CC=C(Cl)S1)NC1=CC(F)=CN=C1

0.565

View
CC1=CN=CC(NC(=O)CC2=CC=C(Cl)S2)=C1

0.565

View
O=C(CCC1=CC=C(Cl)S1)NCCC(=O)NC1=CC=CN=C1

0.559

View
C=CCN(CC(=O)NC1=CC=CN=C1)CC1=CC=C(Cl)S1

0.559

View
O=C(CC1=CC=CN=C1)NNC(=O)CC1=CC=C(Cl)S1

0.557

View
CC(CC1=CC=C(Cl)S1)NCCC(=O)NC1=CC=CN=C1

0.557

View
O=C(CC1=CC=C(Cl)S1)NC1=CN(CC2=CC=CN=C2)N=C1

0.556

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CC(OCC2=CC=CN=C2)=C1

0.554

View
O=C(CC1=CC=C(Cl)C=C1)NC1=CC=CN=C1

0.552

View
O=C(CC1=C(Cl)C=CC=C1Cl)NC1=CC=CN=C1

0.552

View
O=C(COC(=O)CCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.551

View
CCN(CCC(=O)NC1=CC=CN=C1)CC1=CC=C(Cl)S1

0.551

View
O=C(CC1=CC=C(Cl)S1)NC1=CN=CC=N1

0.550

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CC(Cl)=C1

0.550

View
CC1=NC=C(NC(=O)CC2=CC=C(Cl)S2)C=N1

0.550

View
O=C(CC1=CC=C(Cl)S1)NC1=C[NH]N=C1

0.550

View
O=C(NCC1=CC=C(Cl)S1)C(=O)NC1=CC=CN=C1

0.547

View
O=C(CNC(=O)NCCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.543

View
O=C(CC1=CC=C(Cl)S1)NC1=CC(Cl)=NC(Cl)=C1

0.542

View
O=C(CC1=CC=C(Cl)S1)OC1=CC=C(C(=O)NC2=CC=CN=C2)C=C1

0.542

View
O=C(NC1=CC=CN=C1)C1CCN(C(=O)CC2=CC=C(Cl)S2)CC1

0.542

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CC(I)=C1

0.541

View
O=C(CC1=CC=C(Cl)S1)NS(=O)(=O)C1=CC=CN=C1

0.540

View
O=C(CC1=CC=C(Cl)S1)NCC1=CC=CN=C1

0.540

View
CN(CC1=CC=C(Cl)S1)C(=O)NC1=CC=CN=C1

0.538

View
O=C(NCCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.538

View
O=C(CC1=CC=C(Cl)S1)NC1=NC=C(C2=CC=CN=C2)S1

0.536

View
O=C(CCNCCCCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.535

View
O=C(NC1=CC=CN=C1)C1=CC=C(Cl)S1

0.534

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CC(Br)=C1

0.532

View
O=C(CC1=CC=C(Cl)S1)NC1=CN=C(C2=CC=CC=C2)N=C1

0.530

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CC(NC(=O)C2=CC=NC=C2)=C1

0.529

View
O=C(COCCC1=CC=C(Cl)S1)NCC(=O)NC1=CC=CN=C1

0.528

View
C=CCN(CCC(=O)NC1=CC=CN=C1)CC1=CC=C(Cl)S1

0.528

View
O=C(CC1=CC=C(Cl)S1)NC1=NC=CC=N1

0.525

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CN=N1

0.525

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=NC=C1Br

0.524

View
O=C(CC1=CC=C(Cl)S1)NC1=CN=CC=C1O

0.524

View
O=C(CCC(=O)C1=CC=C(Cl)S1)NC1=CC=CN=C1

0.523

View
O=C(CNC(=O)C1=CC=C(Cl)S1)NC1=CC=CN=C1

0.523

View
O=C(CC1=CC=C(Cl)S1)NCCC1=CC=CN=C1

0.523

View
O=C(NCCC1=CC=C(Cl)S1)C(=O)NC1=CC=CN=C1

0.522

View
CCN(CC1=CC=C(Cl)S1)C(=O)NC1=CC=CN=C1

0.522

View
O=C(NCCCCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.522

View
O=C(CC1=CC=C(Cl)S1)NC1=NC(C2=CC=CN=C2)=CS1

0.521

View
O=C(CCC1=CC=C(Cl)S1)NC1=CC=C(C(=O)NC2=CC=CN=C2)C=C1

0.521

View
O=C(COC(=O)COCCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.521

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=NC=C1F

0.516

View
CC1=CC=NC=C1NC(=O)CC1=CC=C(Cl)S1

0.516

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=NC=C1I

0.516

View
CC1=CN=CC=C1NC(=O)CC1=CC=C(Cl)S1

0.516

View
CN(CC1=CC=C(Cl)S1)C(=O)C(=O)NC1=CC=CN=C1

0.515

View
O=C(NC1=CC=CN=C1)C1=CC=C(NCC2=CC=C(Cl)S2)C=C1

0.514

View
O=C(CC1=CSC(C2=CC=C(Cl)S2)=N1)NC1=CC=CN=C1

0.514

View
O=C(CC1=CC=C(Cl)S1)NC1=NC(C2=CC=CN=C2)=NS1

0.514

View
O=C(CNC(=O)NCCCCC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.514

View
O=C(COC(=O)CS(=O)(=O)CC1=CC=C(Cl)S1)NC1=CC=CN=C1

0.514

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=CN=C1Cl

0.508

View
O=C(CC1=CC=C(Cl)S1)NS(=O)(=O)CC1=CC=CN=C1

0.507

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C(CC2=CC=NC=C2)C=C1

0.507

View
O=C(CCNS(=O)(=O)C1=CC=C(Cl)S1)NC1=CC=CN=C1

0.507

View
O=C(CNS(=O)(=O)C1=CC=C(Cl)S1)NC1=CC=CN=C1

0.500

View
ClC1=CC=C(CNC2=CC=CN=C2)S1

0.500

View
O=C(CC1=CC=C(Cl)S1)NC1=CC=C2N=CC=NC2=C1

0.500

View
C=CCN(CC1=CC=C(Cl)S1)C(=O)NC1=CC=CN=C1

0.493

View
O=C(NCCCCC1=CC=C(Cl)S1)C(=O)NC1=CC=CN=C1

0.486

View
Clc1ccc(CC(=O)Nc2cccnc2)s1

1.000

View
Clc1ccc(CC(=O)NCCC(=O)Nc2cccnc2)s1

0.705

View
Cc1ccc(CC(=O)Nc2cccnc2)s1

0.679

View
O=C(Cc1cccs1)Nc1cccnc1

0.586

View
C(NC1=CC=CN=C1)(=O)CC1SC(Cl)=CC=1

1.000

View
C(NC1=CC=NC=C1)(=O)CC1SC(Cl)=CC=1

0.607

View
C(NC1=CN=C(Cl)C=C1)(=O)CC1SC(Cl)=CC=1

0.603

View
C(NC1=CN=C(Br)C=C1)(=O)CC1SC(Cl)=CC=1

0.593

View
C(NC1=CC=CN=C1)(=O)CC1SC=CC=1

0.586

View
C(NC1=CN=C(F)C=C1)(=O)CC1SC(Cl)=CC=1

0.583

View
C(NC1=CN=C(C#C)C=C1)(=O)CC1SC(Cl)=CC=1

0.581

View
C(NC1=CN=C(OC)C=C1)(=O)CC1SC(Cl)=CC=1

0.556

View
C(NC1=CN=C(C#N)C=C1)(=O)CC1SC(Cl)=CC=1

0.556

View
C(NC1=C(Cl)C=CN=C1)(=O)CC1SC(Cl)=CC=1

0.541

View
C(NC1=C(C)C=CN=C1)(=O)CC1SC(Cl)=CC=1

0.516

View
C(NC1=C(Cl)N=CC=C1)(=O)CC1SC(Cl)=CC=1

0.508

View
C(NC1=C(F)N=CC=C1)(=O)CC1SC(Cl)=CC=1

0.500

View
C(NC1=C(Br)N=CC=C1)(=O)CC1SC(Cl)=CC=1

0.492

View
C(NC1=C(OC)N=CC=C1)(=O)CC1SC(Cl)=CC=1

0.464

View
C(NC1=CN=C(Cl)C=C1)(=O)CC1SC=CC=1

0.362

View
C(NC1=C(Cl)C=CN=C1)(CC1SC=CC=1)=O

0.333

View
C(NC1=CN=C(Br)C=C1)(CC1SC=CC=1)=O

0.329

View
C(NC1=CN=C(F)C=C1)(=O)CC1SC=CC=1

0.324

View
C(NC1=C(Cl)N=CC=C1)(=O)CC1SC=CC=1

0.284

View

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