Molecular Properties | |
SMILES: | O=C(CCl)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 |
MW: | 316.06 |
Fraction sp3: | 0.46 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 66.48 |
cLogP: | 2.04 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine BB: | EN300-01623 |
Enamine SCR: | Z56869394 |
Enamine REAL: | Z56869394 |
Enamine Extended REAL: | m_270062____7594844____8147258 |
Mcule: | MCULE-3832521562 |
MolPort: | MolPort-002-462-841 |
Dye 22
Hetero_hetero
VIR-GIT-7b3d3065-2
MAR-TRE-6a44bbf2-43
0.925
AHN-SAT-de2502ba-6
0.925
MAR-TRE-6a44bbf2-100
0.721
AHN-SAT-de2502ba-4
0.721
IND-SYN-6c8299e8-9
0.710
AHN-SAT-de2502ba-18
0.537
AHN-SAT-de2502ba-10
0.529
MAR-TRE-6a44bbf2-89
0.524
AHN-SAT-de2502ba-17
0.515
AHN-SAT-de2502ba-19
0.485
MAR-TRE-6a44bbf2-10
0.467
MAR-TRE-6a44bbf2-59
0.450
AAR-POS-0daf6b7e-11
0.443
MAK-UNK-7a704a63-10
0.443
LON-WEI-8f408cad-1
0.443
MAK-UNK-69bf97dd-1
0.434
MAK-UNK-009ebe36-7
0.429
MAR-TRE-799db12b-34
0.418
SWA-SYN-6423ea73-9
0.417
SWA-SYN-d2e6fa14-10
0.417
IND-SYN-6c8299e8-8
0.417
AHN-SAT-de2502ba-11
0.403
MAK-UNK-009ebe36-2
0.402
BEN-DND-76ad4ac9-6
0.400
MAR-TRE-6a44bbf2-30
0.392
AHN-SAT-de2502ba-2
0.392
AAR-POS-d2a4d1df-38
0.387
BEN-DND-03406596-3
0.382
BEN-DND-76ad4ac9-14
0.382
MAR-TRE-6a44bbf2-18
0.380
LON-WEI-8f408cad-4
0.380
BEN-DND-03406596-10
0.380
AAR-POS-d2a4d1df-23
0.380
MAR-TRE-6a44bbf2-42
0.380
AHN-SAT-de2502ba-13
0.377
MAR-TRE-6a44bbf2-83
0.377
CLI-UNI-032f7715-4
0.375
MAR-TRE-6a44bbf2-65
0.373
TAT-ENA-80bfd3e5-43
0.373
MAK-UNK-7c9d1431-11
0.373
LON-WEI-b8d98729-4
0.372
JAN-GHE-1d98ec1c-7
0.372
SAD-SAT-2fd372d1-3
0.371
DRR-IMP-dff87f5e-8
0.370
MAK-UNK-1e8f9e3c-3
0.369
AHN-SAT-de2502ba-16
0.368
MAK-UNK-7c9d1431-26
0.367
MAR-TRE-6a44bbf2-22
0.367
AHN-SAT-de2502ba-9
0.364
IND-SYN-6c8299e8-2
0.364
MED-COV-4280ac29-10
0.359
MAK-UNK-1e8f9e3c-5
0.353
WAR-XCH-bdd24732-24
0.350
PEI-IMP-ca0b2813-3
0.346
MAK-UNK-7c9d1431-4
0.346
TAT-ENA-80bfd3e5-25
0.346
SAD-SAT-2fd372d1-6
0.344
DAN-MCD-50ec7d1f-1
0.342
MAK-UNK-69bf97dd-9
0.341
MAR-TRE-d0525fbf-45
0.340
SAD-SAT-1f400d17-2
0.338
KEN-MCD-6084b33e-1
0.338
SAD-SAT-6b5a89f0-8
0.333
MAR-TRE-3e4e6814-80
0.330
MAR-TRE-4b834d9a-63
0.330
MAR-TRE-6a44bbf2-90
0.329
MAR-TRE-6a44bbf2-3
0.325
MAC-MCD-4707377b-1
0.325
MAK-UNK-6435e6c2-5
0.324
MAK-UNK-1e8f9e3c-4
0.322
MAR-TRE-6a44bbf2-17
0.319
MAR-TRE-6a44bbf2-93
0.319
BEN-DND-03ad4429-1
0.319
MAR-TRE-fd17a9b8-56
0.319
TAT-ENA-80bfd3e5-27
0.318
MAR-TRE-66ac689e-65
0.318
ABB-MCD-f8003a30-1
0.316
MAR-TRE-6a44bbf2-32
0.316
MAK-UNK-7c9d1431-10
0.316
MAK-UNK-009ebe36-1
0.315
MAK-UNK-1e8f9e3c-6
0.315
SAD-SAT-135344c3-2
0.314
WIL-UNI-1faa9b10-16
0.313
TAT-ENA-80bfd3e5-48
0.312
MAK-UNK-7a704a63-9
0.312
MAR-TRE-6a44bbf2-35
0.312
JAY-UNK-11f5bdbd-1
0.311
KEI-TRE-d5e2018a-22
0.310
MAR-TRE-6a44bbf2-74
0.310
MAR-TRE-66ac689e-76
0.310
MAK-UNK-7c9d1431-5
0.309
MAR-TRE-6a44bbf2-31
0.309
MAK-UNK-009ebe36-5
0.308
DAN-MCD-5c762fbe-1
0.307
BEN-DND-03ad4429-2
0.307
MAK-UNK-10dfa458-5
0.307
BEN-DND-03ad4429-3
0.307
MAK-UNK-7c9d1431-9
0.306
MAR-TRE-6a44bbf2-21
0.306
MAK-UNK-ca11b4f7-1
0.303