Molecule Details

Cc1ccncc1NC(=O)CCl
Enamine Mcule MolPort
Molecular Properties
SMILES:
Cc1ccncc1NC(=O)CCl
MW: 184.04
Fraction sp3: 0.25
HBA: 2
HBD: 1
Rotatable Bonds: 2
TPSA: 41.99
cLogP: 1.57
Covalent Warhead: ✔️
Covalent Fragment: ✔️
Source
Enamine REAL: Z1562137792
Mcule: MCULE-4404668008
MolPort: MolPort-011-131-326
Cc1cccc(CN2CCN(C(=O)CCl)CC2)c1

AAR-POS-d2a4d1df-24

View

Cc1ccncc1NC(=O)CC#N

ASH-SAT-43770c7d-9
0.638

View
CC(=O)Nc1cnccc1C

MAK-UNK-6435e6c2-8
0.619

View
CC(=O)Nc1cnccc1C

AAR-POS-d2a4d1df-3
0.619

View
Cc1ccncc1NC(=O)CCCBr

ALE-HEI-f28a35b5-12
0.600

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

MAT-POS-590ac91e-11
0.600

View
Cc1ccncc1NC(=O)Cc1ccccc1

TRY-UNI-714a760b-5
0.577

View
Cc1ccc(CC(=O)Nc2cnccc2C)cc1

JAN-GHE-83b26c96-11
0.577

View
Cc1ccncc1NC(=O)Cc1cccc(Cl)c1

TRY-UNI-714a760b-6
0.571

View
Cc1ccncc1NC(=O)CC1(CO)CC1

MAT-POS-590ac91e-6
0.566

View
Cc1ccncc1NC(=O)CCCCC(=N)N

PET-SGC-6e7c5dc0-1
0.566

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

EDJ-MED-c9f55a56-1
0.564

View
Cc1ccncc1NC(=O)CC(O)C1CC1

MAT-POS-590ac91e-7
0.556

View
COC1(CC(=O)Nc2cnccc2C)CC1

MAT-POS-590ac91e-9
0.556

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

BEN-DND-93268d01-8
0.554

View
Cc1ccncc1NC(=O)Cc1cncc(Cl)c1

TRY-UNI-2eddb1ff-2
0.554

View
Cc1ccncc1NC(=O)Cc1cncc(Cl)c1

EDG-MED-0da5ad92-8
0.554

View
C=CC(=O)Nc1cnccc1C

MAK-UNK-6ca90168-27
0.553

View
Cc1nnc(CC(=O)Nc2cnccc2C)s1

ALE-HEI-f28a35b5-3
0.545

View
Cc1ccncc1NC(=O)Cc1ccsc1

MIH-UNI-6b9ca91a-1
0.545

View
Cc1ccncc1NC(=O)CN1CCCCC1

BEN-DND-93268d01-11
0.545

View
Cc1ccncc1NC(=O)CC1CC2CC2C1

MAT-POS-590ac91e-23
0.545

View
Cc1ccncc1NC(=O)CC1CCCCC1

EDG-MED-0da5ad92-4
0.545

View
Cc1ccncc1NC(=O)CC1CCCCC1

TRY-UNI-714a760b-10
0.545

View
Cc1ccncc1NC(=O)CN1CCN(C)CC1

BEN-DND-93268d01-9
0.545

View
Cc1ccncc1NC(=O)CC1CCCCC1

ALE-HEI-f28a35b5-6
0.545

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

GAB-REV-70cc3ca5-21
0.545

View
Cc1ccncc1NC(=O)NCCBr

ALE-HEI-f28a35b5-13
0.538

View
Cc1ccncc1NC(=O)CN1CCOCC1

BEN-DND-93268d01-10
0.536

View
Cc1ccncc1NC(=O)CCOC1CC1

MAT-POS-590ac91e-10
0.536

View
Cc1ccncc1NC(=O)CC1CC2(CC2)C1

MAT-POS-590ac91e-24
0.536

View
Cc1ccncc1NC(=O)CCCCC(N)N

ALE-HEI-f28a35b5-10
0.536

View
Cc1ccncc1NC(=O)CCc1cccc(Cl)c1

ALP-POS-f13221e1-4
0.533

View
Cc1ccncc1NC(=O)CCc1ccn[nH]1

MAT-POS-590ac91e-17
0.526

View
Cc1ccncc1NC(=O)CC1(C#N)CCC1

MAT-POS-590ac91e-15
0.526

View
Cc1ccncc1NC(=O)Cc1ccccc1N

ANN-UNI-98d2bf15-1
0.526

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

BEN-DND-93268d01-13
0.517

View
Cc1ccncc1NC(=O)Cc1cccc(CO)c1

EDJ-MED-e58735b6-2
0.517

View
Cc1ccncc1NC(=O)CCc1ccc(F)cc1

BEN-DND-93268d01-5
0.517

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

GAB-REV-70cc3ca5-20
0.517

View
Cc1ccncc1NC(=O)Cc1cccc(O)c1

ALP-POS-95b75b4d-2
0.517

View
Cc1ccncc1NC(=O)Cc1cccc(I)c1

JAN-GHE-83b26c96-13
0.517

View
CO[C@@H](C)C(=O)Nc1cnccc1C

MAT-POS-590ac91e-2
0.510

View
CO[C@H](C)C(=O)Nc1cnccc1C

MAT-POS-590ac91e-1
0.510

View
CO[C@H](C)C(=O)Nc1cnccc1C

ERI-UCB-5b47150d-1
0.510

View
Cc1ccncc1NC(=O)CCSCCS(C)(=O)=O

MAK-UNK-372b0df5-3
0.508

View
Cc1ccncc1NC(=O)CCc1ccccn1

BEN-DND-93268d01-4
0.508

View
Cc1ccncc1NC(=O)Cc1cccc(F)c1

ALP-POS-95b75b4d-1
0.508

View
Cc1ccncc1NC(=O)Cc1cccc(Br)c1

JAN-GHE-83b26c96-12
0.508

View
N#Cc1ccncc1NC(=O)CCl

MAK-UNK-6ca90168-29
0.500

View
Cc1ccncc1NC(=O)CC1CCCNC1

EDG-MED-0da5ad92-9
0.500

View
Cc1ccncc1NC(=O)CNC(=O)Cc1cccnc1

GAB-REV-70cc3ca5-13
0.500

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

RAL-THA-6b94ceba-6
0.492

View
Cc1ccncc1NC(=O)CCNc1ccc(S(N)(=O)=O)cc1

GAB-REV-70cc3ca5-3
0.492

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

MAT-POS-c9973a83-1
0.492

View
Cc1ccncc1NC(=O)CCc1ccccc1F

BEN-DND-93268d01-7
0.492

View
Cc1ccncc1NC(=O)CC12CCCC1C2

MAT-POS-590ac91e-25
0.492

View
COc1cccc(CC(=O)Nc2cnccc2C)c1

EDJ-MED-e58735b6-1
0.492

View
Cc1ccncc1NC(=O)N1CCN(C)CC1

ALE-HEI-f28a35b5-17
0.491

View
Cc1ccncc1NC(=O)N1CCN(C)CC1

SCO-VAN-260d9628-1
0.491

View
CC(C(=O)Nc1cnccc1C)=C1CC1

ERI-UCB-5b47150d-4
0.491

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

WIL-MOD-03b86a88-5
0.485

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

RAL-THA-6b94ceba-14
0.485

View
CNS(=O)(=O)Cc1cc(Cl)cc(CC(=O)Nc2cnccc2C)c1

RAL-THA-6b94ceba-16
0.485

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

PET-SGC-2e937068-1
0.484

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

TRY-UNI-2eddb1ff-1
0.484

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

ALP-POS-95b75b4d-3
0.484

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

JAN-GHE-83b26c96-14
0.484

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

ANN-UNI-98d2bf15-2
0.484

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

DAR-DIA-0cde14eb-76
0.484

View
CC(=O)N[C@@H](C)C(=O)Nc1cnccc1C

MAT-POS-590ac91e-13
0.481

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

WIL-MOD-03b86a88-6
0.478

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

DAR-DIA-0cde14eb-62
0.477

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

RAL-THA-6b94ceba-7
0.477

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

RAL-THA-6b94ceba-13
0.477

View
Cc1ccncc1NC(=O)Cc1ccc2[nH]ncc2c1

VLA-UCB-00f2c2b3-2
0.477

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

TRY-UNI-714a760b-20
0.476

View
Cc1ccncc1NC(=O)CCc1cccc(F)c1

BEN-DND-93268d01-6
0.476

View
Cc1ccncc1NC(=O)NCCCC(N)N

ALE-HEI-f28a35b5-11
0.475

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

ERI-UCB-5b47150d-6
0.474

View
Cc1ccncc1NC(=O)C(C)CC1CC1

MAT-POS-590ac91e-5
0.474

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

MAT-POS-5d20d11c-1
0.473

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

MAT-POS-590ac91e-16
0.473

View
Cc1ccncc1NC(=O)Nc1ccccc1

ALE-HEI-f28a35b5-1
0.473

View
Cc1ccncc1NC(=O)Nc1ccccc1

TRY-UNI-714a760b-4
0.473

View
Cc1ccncc1NC(=O)CC(C(=O)Nc1cnccc1C)c1cccc(Cl)c1

MAK-UNK-f203cb68-3
0.471

View
Cc1ccncc1NC(=O)Cn1ccc2ccc(Cl)cc21

BAR-COM-0f94fc3d-41
0.470

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

DAR-DIA-0cde14eb-3
0.470

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

RAL-THA-6b94ceba-5
0.470

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

RAL-THA-6b94ceba-15
0.470

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

EDJ-MED-e58735b6-3
0.469

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

DAR-DIA-0cde14eb-78
0.469

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

DAR-DIA-0cde14eb-79
0.469

View
Cc1ccncc1NS(C)(=O)=O

IND-SYN-2c708b29-2
0.468

View
Cc1ccncc1NC(=O)C1CC(C2CC2Cl)C1

DAR-DIA-6a508060-12
0.466

View
Cc1ccncc1NC(=O)CCNc1ccc2[nH]ncc2c1

GAB-REV-70cc3ca5-12
0.464

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

WIL-MOD-03b86a88-3
0.463

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

GAB-REV-70cc3ca5-19
0.463

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

RAL-THA-6b94ceba-12
0.463

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

ANN-UNI-98d2bf15-5
0.462

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

DAR-DIA-0cde14eb-61
0.462

View
Cc1ccncc1NC(=O)CCl

1.000

View
Cc1ccncc1NC(=O)CN

0.758

View
Cc1cnccc1NC(=O)CCl

0.758

View
Cc1ccncc1NC(=O)CCCCC(=O)Nc1cnccc1C

0.735

View
Cc1ccncc1NC(=O)CO

0.735

View
Cc1ccncc1NC(=O)CCCC(=O)Nc1cnccc1C

0.735

View
COCC(=O)Nc1cnccc1C

0.735

View
Cc1ccncc1NC(=O)CCCCCC(=O)Nc1cnccc1C

0.714

View
Cc1ccncc1NC(=O)CCCCCCC(=O)Nc1cnccc1C

0.714

View
Cc1ccncc1NC(=O)CSCC(=O)Nc1cnccc1C

0.714

View
Cc1ccncc1NC(=O)COCC(=O)Nc1cnccc1C

0.714

View
Cc1ccncc1NC(=O)CCCCCCCC(=O)Nc1cnccc1C

0.714

View
Cc1ccncc1NC(=O)CN(C)C

0.714

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

0.714

View
CNCC(=O)Nc1cnccc1C

0.714

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

0.703

View
Cc1ccncc1NC(=O)Cc1c(C)cccc1C

0.703

View
Cc1ccncc1NC(=O)CC(C)C

0.694

View
CC(=O)CCC(=O)Nc1cnccc1C

0.694

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

0.694

View
CSCC(=O)Nc1cnccc1C

0.694

View
Cc1ccncc1NC(=O)Cc1ccncc1

0.694

View
Cc1ccncc1NC(=O)CC(C)CC(=O)Nc1cnccc1C

0.694

View
Cc1ccncc1NC(=O)CS(=O)(=O)CC(=O)Nc1cnccc1C

0.694

View
CNC(=O)CCC(=O)Nc1cnccc1C

0.694

View
Cc1ccncc1NC(=O)CCN

0.694

View
Cc1ccncc1NC(=O)Cc1c(Cl)cccc1Cl

0.692

View
O=C(CCl)Nc1cnccc1O

0.686

View
Cc1ccncc1NC(=O)COC(C)(C)C

0.684

View
C=C(Cl)CCC(=O)Nc1cnccc1C

0.684

View
Cc1ccncc1NC(=O)Cc1cnccc1Cl

0.684

View
CCCCC(=O)Nc1cnccc1C

0.676

View
CC(=O)NCC(=O)Nc1cnccc1C

0.676

View
Cc1ccncc1NC(=O)COCCOCC(=O)Nc1cnccc1C

0.676

View
Cc1ccncc1NC(=O)CSc1ccncc1

0.676

View
Cc1ccncc1NC(=O)CCSCCC(=O)Nc1cnccc1C

0.676

View
Cc1ccncc1NC(=O)CC(F)(F)F

0.676

View
Cc1ccncc1NC(=O)CCC(N)=O

0.676

View
Cc1ccncc1NC(=O)CS(C)(=O)=O

0.676

View
CCN(CC)CC(=O)Nc1cnccc1C

0.676

View
Cc1ccncc1NC(=O)CCOCCC(=O)Nc1cnccc1C

0.676

View
Cc1ccncc1NC(=O)CC(O)CC(=O)Nc1cnccc1C

0.676

View
Cc1cnccc1CC(=O)Nc1cnccc1C

0.676

View
Cc1ccncc1NC(=O)CON

0.676

View
CNCCC(=O)Nc1cnccc1C

0.676

View
CCNCC(=O)Nc1cnccc1C

0.676

View
Cc1ccncc1NC(=O)Cc1ccc(Cl)cc1

0.667

View
Cc1ccncc1NC(=O)COc1ccc(Cl)cc1

0.659

View
Cc1ccncc1NC(=O)Cc1c(C)cccc1Cl

0.659

View
CCCCCC(=O)Nc1cnccc1C

0.658

View
CCOCC(=O)Nc1cnccc1C

0.658

View
COC(=O)CC(=O)Nc1cnccc1C

0.658

View
CSCCC(=O)Nc1cnccc1C

0.658

View
Cc1ccncc1NC(=O)CCC(C)C

0.658

View
Cc1ccc(CC(=O)Nc2cnccc2C)cc1

0.658

View
CC(=O)CCCC(=O)Nc1cnccc1C

0.658

View
COCCC(=O)Nc1cnccc1C

0.658

View
Cc1ccncc1NC(=O)CC1CC1

0.658

View
CCSCC(=O)Nc1cnccc1C

0.658

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

0.658

View
CCC(=O)NCC(=O)Nc1cnccc1C

0.658

View
CC(=O)NCC(=O)NCC(=O)Nc1cnccc1C

0.658

View
Cc1ccncc1NC(=O)CCc1ccncc1

0.658

View
Cc1ccncc1NC(=O)CNC(C)(C)C

0.658

View
CCNC(=O)CCC(=O)Nc1cnccc1C

0.658

View
Cc1ccncc1NC(=O)CCC(C)(C)C

0.658

View
Cc1ccncc1NC(=O)Cc1cncnc1

0.658

View
Cc1ccncc1NC(=O)CC(CC(=O)Nc1cnccc1C)C(C)C

0.658

View
C=C(C)CCC(=O)Nc1cnccc1C

0.658

View
Cc1ccncc1NC(=O)CC(C)(F)F

0.658

View
Cc1ccncc1NC(=O)CC(=O)N(C)C

0.658

View
CNC(=O)CCCCC(=O)Nc1cnccc1C

0.658

View
CCC(CC)CC(=O)Nc1cnccc1C

0.658

View
CCNC(=O)CC(=O)Nc1cnccc1C

0.658

View
CNC(=O)CCCC(=O)Nc1cnccc1C

0.658

View
Cc1ccncc1NC(=O)CCCN

0.658

View
Cc1ccncc1NC(=O)CC(C)N

0.658

View
Cc1ccncc1NC(=O)CNC(=O)CN

0.658

View
Cc1ccncc1NC(=O)CNC(C)C

0.658

View
Cc1ccncc1NC(=O)C[C@@H](C)N

0.658

View
Cc1ccncc1NC(=O)C[C@H](C)N

0.658

View
Cc1ccncc1NC(=O)CC(C)(C)N

0.658

View
Cc1ccncc1NC(=O)C(C)(C)CCl

0.658

View
Cc1ccncc1NC(=O)C(F)F

0.657

View
Cc1ccncc1NC(=O)C(C)C(C)C(=O)Nc1cnccc1C

0.657

View
Cc1ccncc1NC(=O)Cc1cccs1

0.650

View
Cc1ccncc1NC(=O)COc1ccccc1

0.650

View
Cc1ccncc1NC(=O)CSc1ccc(Cl)cc1

0.650

View
Cc1ccc(OCC(=O)Nc2cnccc2C)cc1

0.650

View
Cc1ccncc1NC(=O)Cc1c(F)cccc1F

0.650

View
Cc1ccncc1NC(=O)CC(O)C(Cl)(Cl)Cl

0.650

View
Cc1ccncc1NC(=O)Cn1ncc(Cl)c1C

0.650

View
CCC(CC)C(=O)Nc1cnccc1C

0.649

View
Cc1ccncc1NC(=O)C(C)CC(C)C(=O)Nc1cnccc1C

0.649

View
COc1ccncc1NC(=O)CCl

0.649

View
CSc1ccncc1NC(=O)CCl

0.649

View
CCCCCCCCC(=O)Nc1cnccc1C

0.641

View
CCCCCCCC(=O)Nc1cnccc1C

0.641

View
CCCCCCCCCC(=O)Nc1cnccc1C

0.641

View
CCCCCCC(=O)Nc1cnccc1C

0.641

View
CC(=O)Nc1cnccc1C=O

0.196

View
O=C(CCl)Nc1cccnc1

0.186

View
Cl.O=C(CCl)Nc1cccnc1

0.186

View
CC(=O)Nc1cnccc1C

0.124

View
C(NC1=C(C)C=CN=C1)(=O)C

0.913

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

0.896

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

0.848

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

0.823

View
C(NC1=C(C)C=CN=C1)(=O)COC

0.805

View

Discussion: