Molecular Properties | |
SMILES: | Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)CCl |
MW: | 330.08 |
Fraction sp3: | 0.5 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 66.48 |
cLogP: | 2.35 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine BB: | EN300-01948 |
Enamine SCR: | Z56887791 |
Enamine REAL: | Z56887791 |
Enamine Extended REAL: | m_270062____7626656____8147258 |
Mcule: | MCULE-7483175819 |
MolPort: | MolPort-002-462-919 |
Dye 22
Hetero_hetero
VIR-GIT-7b3d3065-2
AHN-SAT-de2502ba-9
0.721
AHN-SAT-de2502ba-18
0.661
AHN-SAT-de2502ba-17
0.635
AHN-SAT-de2502ba-19
0.603
AHN-SAT-de2502ba-5
0.529
AHN-SAT-de2502ba-6
0.478
MAR-TRE-6a44bbf2-43
0.478
MAR-TRE-6a44bbf2-89
0.477
SAD-SAT-2fd372d1-3
0.477
AHN-SAT-de2502ba-16
0.465
AHN-SAT-de2502ba-11
0.440
MAR-TRE-8190bb11-100
0.430
MAK-UNK-7c9d1431-8
0.414
MAR-TRE-6a44bbf2-26
0.414
CLI-UNI-032f7715-4
0.397
MAK-UNK-7c9d1431-26
0.385
MAR-TRE-6a44bbf2-22
0.385
AHN-SAT-de2502ba-2
0.373
MAR-TRE-6a44bbf2-30
0.373
MAK-UNK-69bf97dd-1
0.368
SAD-SAT-2fd372d1-6
0.365
MAR-TRE-6a44bbf2-100
0.364
AHN-SAT-de2502ba-4
0.364
IND-SYN-6c8299e8-9
0.359
MAR-TRE-6a44bbf2-83
0.359
AHN-SAT-de2502ba-13
0.359
MAK-UNK-69bf97dd-9
0.357
ABB-MCD-f8003a30-1
0.351
MAR-TRE-6a44bbf2-32
0.351
MAK-UNK-6ca90168-26
0.348
JAY-UNK-11f5bdbd-1
0.347
MAR-TRE-6a44bbf2-31
0.342
MAK-UNK-7c9d1431-5
0.342
SAD-SAT-1f400d17-2
0.338
MAK-UNK-7c9d1431-19
0.338
MAK-UNK-7264f48c-3
0.337
AAR-POS-d2a4d1df-27
0.333
MAR-LAB-efb042c5-5
0.333
MAR-TRE-6a44bbf2-68
0.333
BEN-DND-93268d01-11
0.333
MAK-UNK-7c9d1431-10
0.333
MAK-UNK-009ebe36-7
0.333
BEN-DND-76ad4ac9-14
0.329
BEN-DND-03406596-3
0.329
PEI-IMP-ca0b2813-3
0.329
MAR-TRE-6a44bbf2-49
0.325
MAK-UNK-7c9d1431-7
0.325
MAR-TRE-6a44bbf2-18
0.324
AAR-POS-d2a4d1df-23
0.324
BEN-DND-03406596-10
0.324
LON-WEI-8f408cad-4
0.324
BEN-DND-76ad4ac9-6
0.324
MAK-UNK-7c9d1431-11
0.321
MAR-TRE-6a44bbf2-65
0.321
TAT-ENA-80bfd3e5-43
0.321
MAR-TRE-6a44bbf2-93
0.319
MAK-UNK-69bf97dd-5
0.319
DRR-IMP-dff87f5e-8
0.316
MAR-TRE-6a44bbf2-42
0.313
MAK-UNK-7c9d1431-2
0.313
MAR-TRE-6a44bbf2-36
0.313
IND-SYN-6c8299e8-2
0.312
MAK-UNK-7c9d1431-3
0.312
MAK-UNK-7c9d1431-4
0.312
DRR-IMP-dff87f5e-2
0.312
TAT-ENA-80bfd3e5-25
0.312
AAR-POS-d2a4d1df-36
0.312
MAR-TRE-6a44bbf2-78
0.311
MAK-UNK-7c9d1431-13
0.311
MAK-UNK-7c9d1431-1
0.305
MAR-TRE-6a44bbf2-38
0.305
SAD-SAT-2ceae68f-6
0.304
BEN-DND-03406596-8
0.304
TAT-ENA-80bfd3e5-27
0.303
SAD-SAT-9a6c5cf3-2
0.303
MAK-UNK-7c9d1431-17
0.303
MAK-UNK-7c9d1431-6
0.303
DRR-IMP-dff87f5e-3
0.301
AAR-POS-d2a4d1df-44
0.301
MAK-UNK-009ebe36-1
0.301
MAR-TRE-d0525fbf-45
0.300
BAP-BUY-55f8bcae-1
0.300
SAD-SAT-9a6c5cf3-7
0.300
MAR-TRE-4f781e27-67
0.299
SER-UNI-985a0e14-3
0.298
KAY-MCD-d0fe5261-1
0.297
MAT-POS-ee51dedd-2
0.297
DRR-IMP-dff87f5e-7
0.297
MAR-TRE-6a44bbf2-58
0.297
DRR-IMP-dff87f5e-1
0.297
KEI-TRE-d5e2018a-13
0.297
BEN-DND-09b88bf4-3
0.296
BEN-DND-6de5dfa0-3
0.296
NAU-LAT-3f5f3993-5
0.296
MAK-UNK-7264f48c-5
0.295
RHE-UNK-eb059eb9-1
0.295
AAR-POS-0daf6b7e-3
0.295
WAR-XCH-79d12f6e-6
0.295
MAR-TRE-6a44bbf2-13
0.295
SAD-SAT-9a6c5cf3-6
0.293