Molecule Details

Cc1ccncc1NC(=O)Cc1nc2ccccc2[nH]1
3-aminopyridine-like
Molecular Properties
SMILES:
Cc1ccncc1NC(=O)Cc1nc2ccccc2[nH]1
MW: 266.304
Fraction sp3: 0.13
HBA: 3
HBD: 2
Rotatable Bonds: 3
TPSA: 70.67
cLogP: 2.44752
Covalent Warhead:
Covalent Fragment:
CC(=O)Nc1cnccc1C

MAK-UNK-6435e6c2-8

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Cc1ccncc1NC(=O)Cc1ccccc1

TRY-UNI-714a760b-5
0.507

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Cc1ccncc1NC(=O)Cc1ccccc1N

ANN-UNI-98d2bf15-1
0.493

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Cc1ccncc1NC(=O)CNc1c[nH]c2ccccc12

GAB-REV-70cc3ca5-17
0.481

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Cc1ccncc1NC(=O)CN(C)c1cc2ccccc2[nH]1

GAB-REV-70cc3ca5-7
0.476

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Cc1ccc(CC(=O)Nc2cnccc2C)cc1

JAN-GHE-83b26c96-11
0.465

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Cc1ccncc1NC(=O)Cc1cccc(F)c1

ALP-POS-95b75b4d-1
0.461

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Cc1cc(CC(=O)Nc2cnccc2C)[nH]n1

EDJ-MED-c9f55a56-1
0.459

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Cc1ccncc1NC(=O)CCCBr

ALE-HEI-f28a35b5-12
0.457

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Cc1ccncc1NC(=O)CCl

MAK-UNK-6ca90168-26
0.455

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Cc1ccncc1NC(=O)Cc1cncc(Cl)c1

TRY-UNI-2eddb1ff-2
0.453

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Cc1ccncc1NC(=O)Cc1cncc(Cl)c1

EDG-MED-0da5ad92-8
0.453

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Cc1ccncc1NC(=O)Cc1nc2cccc(C)c2o1

GAB-REV-70cc3ca5-23
0.451

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Cc1ccncc1NC(=O)Cc1cccc(CO)c1

EDJ-MED-e58735b6-2
0.447

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Cc1ccncc1NC(=O)Cc1ccc(S(N)(=O)=O)cc1

GAB-REV-70cc3ca5-20
0.447

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Cc1ccncc1NC(=O)Cc1cccc(I)c1

JAN-GHE-83b26c96-13
0.447

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Cc1ccncc1NC(=O)Cc1cccc(O)c1

ALP-POS-95b75b4d-2
0.447

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Cc1ccncc1NC(=O)Cc1cccc(Cl)c1

TRY-UNI-714a760b-6
0.447

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Cc1ccncc1NC(=O)Cc1ccsc1

MIH-UNI-6b9ca91a-1
0.446

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Cc1nnc(CC(=O)Nc2cnccc2C)s1

ALE-HEI-f28a35b5-3
0.446

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Cc1ccncc1NC(=O)Cc1ccc2nc[nH]c2c1

GAB-REV-70cc3ca5-18
0.446

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Cc1ccncc1NC(=O)Cc1cccc(Br)c1

JAN-GHE-83b26c96-12
0.442

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Cc1ccncc1NC(=O)Cc1ccc2[nH]ncc2c1

VLA-UCB-00f2c2b3-2
0.439

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Cc1ccncc1NC(=O)Cc1ccccc1Cc1ccccn1

THO-SYG-cc9e9a11-1
0.439

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Cc1ccncc1NC(=O)CCCCC(=N)N

PET-SGC-6e7c5dc0-1
0.438

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Cc1ccncc1NC(=O)CNC(=O)Cc1cccnc1

GAB-REV-70cc3ca5-13
0.436

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Cc1ccncc1NC(=O)CC#N

ASH-SAT-43770c7d-9
0.435

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Cc1ccncc1NC(=O)Cc1ccc2[nH]ccc2c1

VLA-UCB-00f2c2b3-1
0.434

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Cc1ccncc1NC(=O)Cc1ccccc1-c1ccccn1

THO-SYG-cc9e9a11-2
0.434

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Cc1ccncc1NC(=O)CCc1ccccc1F

BEN-DND-93268d01-7
0.430

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COc1cccc(CC(=O)Nc2cnccc2C)c1

EDJ-MED-e58735b6-1
0.430

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Cc1ccncc1NC(=O)CCc1ccc(F)cc1

BEN-DND-93268d01-5
0.429

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Cc1ccncc1NC(=O)CC(C)(C)NC(=O)c1cccc2[nH]ccc12

GAB-REV-70cc3ca5-6
0.429

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Cc1ccncc1NC(=O)CNc1ccnc2ccccc12

GAB-REV-70cc3ca5-4
0.429

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Cc1ccncc1NC(=O)Cc1cccc(C2CC2)c1

ALP-POS-95b75b4d-4
0.427

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

ALP-POS-95b75b4d-3
0.425

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

JAN-GHE-83b26c96-14
0.425

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

DAR-DIA-0cde14eb-76
0.425

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

ANN-UNI-98d2bf15-2
0.425

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Cc1ccncc1NC(=O)CCc1ccccn1

BEN-DND-93268d01-4
0.423

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Cc1ccncc1NC(=O)CC1CC2(CC2)C1

MAT-POS-590ac91e-24
0.421

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Cc1ccncc1NC(=O)CCOC1CC1

MAT-POS-590ac91e-10
0.421

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Cc1ccncc1NC(=O)CCCCC(N)N

ALE-HEI-f28a35b5-10
0.421

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

TRY-UNI-714a760b-20
0.420

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Cc1ccncc1NC(=O)CC1(CO)CC1

MAT-POS-590ac91e-6
0.419

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Cc1ccncc1NC(=O)Cc1cccc2c1CNCC2

ADA-UCB-6c2cb422-4
0.419

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

MAT-POS-590ac91e-11
0.417

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Cc1ccncc1NC(=O)CCc1ccn[nH]1

MAT-POS-590ac91e-17
0.416

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Cc1ccncc1NC(=O)Cc1cccc([S+](C)[O-])c1

DAR-DIA-0cde14eb-78
0.415

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Cc1ccncc1NC(=O)Cc1cccc(S(N)(=O)=O)c1

EDJ-MED-e58735b6-3
0.415

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

DAR-DIA-0cde14eb-79
0.415

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Cc1ccncc1NC(=O)CC(O)C1CC1

MAT-POS-590ac91e-7
0.413

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COc1ccc(-c2csc(CC(=O)Nc3cnccc3C)n2)cc1

GAB-REV-70cc3ca5-15
0.412

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Cc1ccncc1NC(=O)Cc1nc2ncccc2o1

GAB-REV-70cc3ca5-11
0.412

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

BEN-DND-93268d01-13
0.410

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

ANN-UNI-98d2bf15-5
0.410

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Cc1ccncc1NC(=O)Cc1cnn(C2(I)CC2)c1

DAR-DIA-0cde14eb-64
0.410

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Cc1ccncc1NC(=O)Cc1cccc(C2(C)CC2)c1

DAR-DIA-0cde14eb-1
0.410

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Cc1ccncc1NC(=O)Cc1ccccc1CN1CCC(O)CC1

SAM-UNK-2684b532-9
0.409

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Cc1ccncc1NC(=O)CC1CC2CC2C1

MAT-POS-590ac91e-23
0.408

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CC(=O)Nc1ccc(NCC(=O)Nc2cnccc2C)cc1

GAB-REV-70cc3ca5-21
0.408

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

TRY-UNI-2eddb1ff-1
0.407

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Cc1ccncc1NC(=O)Cc1cccc(-c2cn[nH]c2)c1

EDJ-MED-e58735b6-4
0.407

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CC(=O)Nc1cnccc1C

AAR-POS-d2a4d1df-3
0.406

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CC(=O)Nc1cnccc1C

MAK-UNK-6435e6c2-8
0.406

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Cc1ccncc1NC(=O)Cc1cccc(C2(F)CC2)c1

DAR-DIA-0cde14eb-2
0.405

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Cc1ccncc1NC(=O)CNC(=O)c1ccc2nc[nH]c2c1

GAB-REV-70cc3ca5-5
0.404

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Cc1ccncc1NC(=O)Cc1cc(Cl)cc(-c2ncc[nH]2)c1

RAL-THA-6b94ceba-9
0.402

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

RAL-THA-6b94ceba-15
0.400

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CCC(F)(F)c1cccc(CC(=O)Nc2cnccc2C)c1

DAR-DIA-0cde14eb-77
0.400

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Cc1ccncc1NC(=O)Cc1cccc(C2(I)CC2)c1

DAR-DIA-0cde14eb-4
0.400

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Cc1ccncc1NC(=O)Cc1cccc(C2(Cl)CC2)c1

DAR-DIA-0cde14eb-3
0.400

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

RAL-THA-6b94ceba-5
0.400

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

MAT-POS-c9973a83-1
0.398

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

RAL-THA-6b94ceba-6
0.398

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C=CC(=O)Nc1cnccc1C

MAK-UNK-6ca90168-27
0.397

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CCNc1ncc(C#N)cc1CC(=O)Nc1cnccc1C

TRY-UNI-1fd04853-1
0.395

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Cc1ccncc1NC(=O)Cc1cc(Cl)cc(CNS(C)(=O)=O)c1

RAL-THA-6b94ceba-12
0.395

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CCNc1ncc(C#N)cc1CC(=O)Nc1cnccc1C

PET-SGC-175e168c-1
0.395

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COC1(CC(=O)Nc2cnccc2C)CC1

MAT-POS-590ac91e-9
0.395

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CC(=O)CCCc1c[nH]c2c(CC(=O)Nc3cnccc3C)cccc12

RAM-SYN-2a37ce6c-3
0.394

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

BRU-LEF-c49414a7-1
0.393

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

RAL-THA-901e9a10-7
0.393

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Cc1ccncc1NC(=O)Cc1cnn(C2(C)CC2)c1

DAR-DIA-0cde14eb-61
0.393

View
Cc1ccncc1NC(=O)CCNC(=O)c1ccccc1F

PET-SGC-2e937068-1
0.393

View
Cc1ccncc1NC(=O)Nc1ccccc1

TRY-UNI-714a760b-4
0.392

View
Cc1ccncc1NC(=O)Nc1ccccc1

ALE-HEI-f28a35b5-1
0.392

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CC(O)CNCc1nc2ccccc2[nH]1

MAK-UNK-3ae66343-1
0.392

View
Cc1ccncc1NC(=O)Cc1cc(C#N)ccc1-c1ccccn1

THO-SYG-cc9e9a11-4
0.391

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

WIL-MOD-03b86a88-6
0.391

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

RAL-THA-6b94ceba-8
0.391

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Cc1ccncc1NC(=O)CCc1cccc(Cl)c1

ALP-POS-f13221e1-4
0.390

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Cc1ccncc1NC(=O)CN1CCCCC1

BEN-DND-93268d01-11
0.390

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Cc1ccncc1NC(=O)CN1CCN(C)CC1

BEN-DND-93268d01-9
0.390

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Cc1ccncc1NC(=O)CC1CCCCC1

EDG-MED-0da5ad92-4
0.390

View
Cc1ccncc1NC(=O)CC1CCCCC1

ALE-HEI-f28a35b5-6
0.390

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Cc1ccncc1NC(=O)CC1CCCCC1

TRY-UNI-714a760b-10
0.390

View
Cc1ccncc1NC(=O)Cc1cnn(C2(F)CC2)c1

DAR-DIA-0cde14eb-63
0.388

View
Cc1ccncc1NC(=O)Cc1cc(Cl)cc(S(N)(=O)=O)c1

RAL-THA-6b94ceba-13
0.388

View
CNC(=O)c1cc(Cl)cc(CC(=O)Nc2cnccc2C)c1

RAL-THA-6b94ceba-7
0.388

View
Cc1ccncc1NC(=O)Cc1cnn(C2(Cl)CC2)c1

DAR-DIA-0cde14eb-62
0.388

View
Cc1ccncc1NC(=O)CCc1nc2ccccc2[nH]1

0.787

View
Cc1ccncc1NC(=O)CSc1nc2ccccc2[nH]1

0.694

View
Cc1ccncc1NC(=O)C(=O)NCCc1nc2ccccc2[nH]1

0.673

View
Cc1ccncc1NC(=O)NCCCc1nc2ccccc2[nH]1

0.660

View
Cc1ccncc1NC(=O)C(=O)NCCCc1nc2ccccc2[nH]1

0.648

View
Cc1cnccc1NC(=O)CCc1nc2ccccc2[nH]1

0.647

View
Cc1ccncc1NC(=O)Cc1c(C)[nH]c2ccccc12

0.640

View
Cc1ccncc1NC(=O)Cc1c[nH]c2ccccc12

0.627

View
Cc1cnccc1NC(=O)CCCc1nc2ccccc2[nH]1

0.623

View
Cc1ccncc1NC(=O)CSC(C)c1nc2ccccc2[nH]1

0.618

View
Cc1ccccc1CC(=O)Nc1cnccc1C

0.617

View
Cc1n[nH]c(CC(=O)Nc2cnccc2C)n1

0.612

View
Cc1ccncc1NC(=O)Cc1ncc[nH]1

0.604

View
Cc1ccncc1NC(=O)CCc1nc2ccccc2c(=O)[nH]1

0.604

View
Cc1ccncc1NC(=O)Cc1ccc(CC(=O)Nc2cnccc2C)cc1

0.600

View
Cc1ccncc1NC(=O)Cc1n[nH]c2ccccc12

0.596

View
Cc1ccncc1NC(=O)Cc1c(C)cccc1C

0.596

View
Cc1ccncc1NC(=O)Cc1cc2ccccc2[nH]c1=O

0.593

View
CSc1ccncc1NC(=O)CCc1nc2ccccc2[nH]1

0.593

View
Cc1ccncc1NC(=O)Cc1cccs1

0.592

View
CCc1ccccc1CC(=O)Nc1cnccc1C

0.592

View
Cc1ccncc1NC(=O)Cc1ccccc1CO

0.592

View
Cc1ccncc1NC(=O)CCl

0.591

View
Cc1ccncc1NC(=O)Cc1ccncc1

0.587

View
Cc1cnccc1CC(=O)NCc1nc2ccccc2[nH]1

0.585

View
Cc1ccncc1NC(=O)Cc1c(C)nc2ccccc2c1C

0.585

View
O=C(CCc1nc2ccccc2[nH]1)Nc1cnccc1O

0.585

View
Cc1ccncc1NC(=O)CSc1ccccc1

0.583

View
Cc1ccncc1NC(=O)Cc1cccnc1

0.583

View
Cc1ccncc1NC(=O)CCCc1nc2ccccc2c(=O)[nH]1

0.582

View
COc1ccncc1NC(=O)CCc1nc2ccccc2[nH]1

0.582

View
Cc1ccccc1NC(=O)CCc1nc2ccccc2[nH]1

0.580

View
Cc1ccncc1NC(=O)Cc1ccc(-c2ccccc2)cc1

0.580

View
Cc1ccncc1NC(=O)Cc1ccccc1F

0.580

View
Cc1ccncc1NC(=O)Cc1ccccc1Cl

0.580

View
Cc1ccncc1NC(=O)Cc1ccccc1I

0.580

View
Cc1ccncc1NC(=O)Cc1ccccc1Br

0.580

View
Cc1ccncc1C(=O)NCc1nc2ccccc2[nH]1

0.577

View
Cc1nc(C)c(CC(=O)Nc2cnccc2C)c(=O)[nH]1

0.577

View
Cc1cnccc1CC(=O)Nc1cnccc1C

0.574

View
Cc1cnccc1NC(=O)C(C)(C)Cc1nc2ccccc2[nH]1

0.574

View
Cc1ccncc1NC(=O)NC(C)c1nc2ccccc2[nH]1

0.574

View
Cc1ccncc1CC(=O)NCCCc1nc2ccccc2[nH]1

0.571

View
Cc1ccncc1NC(=O)Cc1c(C)[nH]c(-c2ncccn2)nc1=O

0.571

View
CC(C)(C)Oc1ccncc1NC(=O)CCc1nc2ccccc2[nH]1

0.571

View
COc1ccccc1CC(=O)Nc1cnccc1C

0.569

View
Cc1ccncc1NC(=O)Cc1ccc(-n2cccc2)cc1

0.569

View
CC(=O)Nc1ccccc1CC(=O)Nc1cnccc1C

0.569

View
Cc1ccncc1NC(=O)Cc1cccc(C)c1Cl

0.569

View
Cc1ccncc1NC(=O)Cc1ccccc1[N+](=O)[O-]

0.566

View
Cc1ccncc1NC(=O)Cc1cnc2ccccc2c1

0.566

View
Cc1cnccc1NC(=O)CSc1nc2ccccc2[nH]1

0.566

View
Cc1cnccc1CC(=O)NCCc1nc2ccccc2[nH]1

0.564

View
Cc1ccncc1NC(=O)CCc1nc2cccnc2[nH]1

0.564

View
Cc1ccncc1NC(=O)C(O)C(O)c1nc2ccccc2[nH]1

0.564

View
Cc1ccncc1CNC(=O)CCc1nc2ccccc2[nH]1

0.564

View
O=C(CCc1nc2ccccc2[nH]1)Nc1cnccc1-c1ccccc1

0.564

View
O=C(CCCc1nc2ccccc2[nH]1)Nc1cnccc1O

0.564

View
Cc1ccncc1NC(=O)C(=O)NC(C)c1nc2ccccc2[nH]1

0.564

View
Cc1ccc(CC(=O)Nc2cnccc2C)cc1

0.562

View
Cc1cc(C)c(CC(=O)Nc2cnccc2C)c(C)c1

0.562

View
Cc1ccncc1NC(=O)Cc1cncnc1

0.562

View
Cc1ccncc1NC(=O)c1ccccc1CSc1nc2ccccc2[nH]1

0.561

View
Cc1ccc(-c2ccncc2)cc1NC(=O)CCc1nc2ccccc2[nH]1

0.561

View
Cc1ccncc1NC(=O)Cc1c(Cl)cccc1Cl

0.560

View
Cc1ccncc1NC(=O)Cc1c(F)cccc1F

0.560

View
Cc1ccncc1NC(=O)Cc1ccco1

0.560

View
Cc1nccn1-c1ccncc1NC(=O)CCc1nc2ccccc2[nH]1

0.559

View
Cc1ccc(-c2cccnc2)cc1NC(=O)CCc1nc2ccccc2[nH]1

0.559

View
Cc1ccncc1NC(=O)Cc1cccc2ccccc12

0.558

View
Cc1ccncc1NC(=O)Cc1ccc2ccccc2c1

0.558

View
Cc1ccncc1NC(=O)Cc1cccc(Cl)c1Cl

0.558

View
CSc1ccccc1CC(=O)Nc1cnccc1C

0.558

View
Cc1ccncc1NC(=O)Cn1c(C)nc2ccccc21

0.558

View
Cc1ccncc1NC(=O)Cn1nnc2ccccc21

0.558

View
Cc1ccccc1NC(=O)CCCc1nc2ccccc2[nH]1

0.558

View
Cc1ccncc1C(=O)NCCc1nc2ccccc2[nH]1

0.556

View
Cc1ccncc1NC(=O)CCc1c[nH]c2ccccc12

0.556

View
Cc1ccncc1NC(=O)Cc1c[nH]c2cccc(C)c12

0.556

View
Cc1ccncc1NC(=O)Cc1coc2ccccc12

0.556

View
O=C(CCc1nc2ccccc2[nH]1)Nc1ccncc1I

0.556

View
O=C(CCc1nc2ccccc2[nH]1)Nc1ccncc1O

0.556

View
Cc1ccncc1NC(=O)CN

0.556

View
Cc1ccncc1CCNC(=O)CCc1nc2ccccc2[nH]1

0.554

View
Cc1ccncc1NC(=O)NC(c1nc2ccccc2[nH]1)C(C)C

0.554

View
Cc1ccncc1NC(=O)CCN

0.553

View
Cc1ccncc1NC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1

0.552

View
Cc1ccncc1NC(=O)N[C@H]1CC[C@@H](c2nc3ccccc3[nH]2)CC1

0.552

View
Cc1ccncc1NC(=O)Cc1ccc(O)cc1

0.551

View
Cc1cc(C)cc(CC(=O)Nc2cnccc2C)c1

0.551

View
CCc1ccc(CC(=O)Nc2cnccc2C)cc1

0.551

View
Cc1ccncc1NC(=O)Cc1cnccc1Cl

0.551

View
Cc1ccncc1NC(=O)CCSc1ccccc1

0.549

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Cc1cccc(CC(=O)Nc2cnccc2C)c1

0.549

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Cc1nc(CC(=O)Nc2cnccc2C)c(C)s1

0.549

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Cc1ccncc1NC(=O)Cc1cccnc1C

0.549

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Cc1ccccc1NC(=O)CSCc1nc2ccccc2[nH]1

0.547

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Cc1ccncc1NC(=O)Cc1ccccc1C(F)(F)F

0.547

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Cc1ccncc1NC(=O)Cc1ccccc1NS(C)(=O)=O

0.547

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Cc1ccncc1NC(=O)Cc1ccccc1CC#N

0.547

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C(NC1=C(C)C=CN=C1)(=O)CC1=NC2=C(C=CC(=C2)Br)N1

0.911

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C(NC1=C(C)C=CN=C1)(=O)CCC1=NC2=C(C=CC=C2)N1

0.884

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C(NC1=C(C)C=CN=C1)(=O)CCCC1=NC2=C(C=CC=C2)N1

0.870

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C(NC1=CN=CC(Cl)=C1C)(=O)CC1=NC2=C(C=CC(=C2)Br)N1

0.843

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C(NC1=CC=CN=C1)(=O)CC1=NC2=C(C=CC(=C2)Br)N1

0.825

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