Molecular Properties | |
SMILES: | Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)CCl |
MW: | 332.06 |
Fraction sp3: | 0.46 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 75.71 |
cLogP: | 1.19 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine BB: | EN300-01628 |
Enamine SCR: | Z56867262 |
Enamine REAL: | Z56867262 |
Enamine Extended REAL: | m_270062____7626640____8147258 |
Mcule: | MCULE-5856737418 |
MolPort: | MolPort-002-462-843 |
Dye 22
Hetero_hetero
VIR-GIT-7b3d3065-2
AHN-SAT-de2502ba-10
0.721
AHN-SAT-de2502ba-16
0.667
MAR-TRE-8190bb11-100
0.606
AHN-SAT-de2502ba-4
0.536
MAR-TRE-6a44bbf2-100
0.536
MAR-TRE-6a44bbf2-83
0.507
AHN-SAT-de2502ba-13
0.507
AHN-SAT-de2502ba-19
0.478
AHN-SAT-de2502ba-17
0.465
AHN-SAT-de2502ba-18
0.465
MAR-TRE-6a44bbf2-42
0.447
MAR-TRE-4f781e27-67
0.443
MAK-UNK-69bf97dd-5
0.440
MAR-TRE-6a44bbf2-63
0.434
KEI-TRE-d5e2018a-13
0.434
TAT-ENA-80bfd3e5-27
0.427
MAR-TRE-a9136c7b-65
0.412
MAK-UNK-7c9d1431-8
0.408
MAR-TRE-6a44bbf2-26
0.408
SAD-SAT-65574d3f-8
0.377
MAR-TRE-6a44bbf2-20
0.377
AHN-SAT-de2502ba-12
0.377
MAR-TRE-6a44bbf2-43
0.373
AHN-SAT-de2502ba-6
0.373
MAR-TRE-a9136c7b-38
0.372
KEI-TRE-d5e2018a-9
0.368
MAR-TRE-6a44bbf2-89
0.366
KEI-TRE-d5e2018a-10
0.365
MAK-UNK-6ca90168-26
0.364
AHN-SAT-de2502ba-5
0.364
SAD-SAT-9a6c5cf3-1
0.362
MAR-TRE-799db12b-34
0.361
SAD-SAT-f0a2747f-5
0.359
KEI-TRE-d5e2018a-61
0.356
KEI-TRE-d5e2018a-53
0.356
IND-SYN-6c8299e8-9
0.354
KEI-TRE-d5e2018a-22
0.353
MAR-TRE-6a44bbf2-32
0.347
ABB-MCD-f8003a30-1
0.347
JAY-UNK-11f5bdbd-1
0.342
BEN-DND-93268d01-10
0.342
MAR-TRE-fd17a9b8-62
0.341
KEI-TRE-d5e2018a-32
0.337
MAR-TRE-3e4e6814-34
0.337
MAR-TRE-a9136c7b-16
0.337
MAR-TRE-6a44bbf2-38
0.333
MAK-UNK-7c9d1431-19
0.333
MAK-UNK-7264f48c-3
0.333
KEI-TRE-d5e2018a-52
0.333
MAK-UNK-7c9d1431-1
0.333
MAR-TRE-2fd8122f-35
0.330
MAR-TRE-67513f76-51
0.330
MAK-UNK-7c9d1431-10
0.329
MAR-LAB-efb042c5-5
0.329
AAR-POS-d2a4d1df-27
0.329
MAR-TRE-6a44bbf2-68
0.329
SAD-SAT-f0a2747f-7
0.326
MAK-UNK-7c9d1431-2
0.325
MAR-TRE-6a44bbf2-36
0.325
DRR-IMP-dff87f5e-2
0.325
PEI-IMP-ca0b2813-3
0.325
MAK-UNK-7c9d1431-3
0.325
MAK-UNK-7c9d1431-7
0.321
MAR-TRE-6a44bbf2-34
0.321
MAR-TRE-6a44bbf2-49
0.321
MAR-TRE-6a44bbf2-31
0.321
MAK-UNK-7c9d1431-5
0.321
AAR-POS-d2a4d1df-23
0.320
BEN-DND-03406596-10
0.320
LON-WEI-8f408cad-4
0.320
MAR-TRE-6a44bbf2-18
0.320
MAR-TRE-2fd8122f-15
0.318
TAT-ENA-80bfd3e5-43
0.316
MAR-TRE-6a44bbf2-65
0.316
MAK-UNK-7c9d1431-11
0.316
MAR-TRE-c317dd82-22
0.315
MAR-TRE-6a44bbf2-93
0.315
MAR-TRE-6a44bbf2-22
0.313
MAK-UNK-7c9d1431-26
0.313
AHN-SAT-de2502ba-11
0.313
DRR-IMP-dff87f5e-8
0.312
SAD-SAT-2fd372d1-3
0.311
TAT-ENA-80bfd3e5-25
0.309
BEN-DND-09b88bf4-3
0.309
MAK-UNK-7c9d1431-4
0.309
NAU-LAT-3f5f3993-5
0.309
BEN-DND-6de5dfa0-3
0.309
AAR-POS-d2a4d1df-36
0.308
MAK-UNK-7264f48c-6
0.308
MAK-UNK-7264f48c-5
0.307
MAK-UNK-7c9d1431-13
0.307
MAR-TRE-6a44bbf2-78
0.307
MAR-TRE-2fd8122f-55
0.305
BEN-DND-76ad4ac9-6
0.303
BEN-DND-6de5dfa0-16
0.301
NIR-THE-b7e8e081-2
0.301
BAR-COM-0f94fc3d-26
0.301
SAD-SAT-7d5528d9-1
0.300
MAK-UNK-7c9d1431-17
0.299
MAK-UNK-7c9d1431-6
0.299