Molecular Properties | |
SMILES: | Cc1cccc(NS(=O)(=O)c2ccc(C(=O)Nc3cccnc3)cc2)c1C |
MW: | 381.11 |
Fraction sp3: | 0.1 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 5 |
TPSA: | 88.16 |
cLogP: | 3.75 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z31791321 |
Mcule: | MCULE-7449145256 |
Hetero_hetero
MAR-TRE-2fd8122f-82
0.746
MAR-TRE-2fd8122f-65
0.623
MAR-TRE-2fd8122f-34
0.550
KEI-TRE-d5e2018a-86
0.494
MAR-TRE-2fd8122f-58
0.487
KEI-TRE-d5e2018a-70
0.477
MAR-TRE-2fd8122f-22
0.477
MAR-TRE-3e4e6814-34
0.470
KEI-TRE-d5e2018a-32
0.470
MAR-TRE-f6f5f473-75
0.465
MAR-TRE-f6f5f473-79
0.443
MAR-TRE-f6f5f473-29
0.430
KEI-TRE-d5e2018a-28
0.430
KEI-TRE-d5e2018a-82
0.429
MAR-TRE-04c86cea-65
0.424
KEI-TRE-d5e2018a-100
0.407
KEI-TRE-d5e2018a-90
0.392
KEI-TRE-d5e2018a-91
0.391
KEI-TRE-d5e2018a-22
0.385
KEI-TRE-d5e2018a-36
0.385
MAR-TRE-2fd8122f-84
0.383
KEI-TRE-d5e2018a-71
0.383
MAR-TRE-2fd8122f-71
0.380
CHR-SOS-7098f804-12
0.380
KEI-TRE-d5e2018a-56
0.379
MAR-TRE-2fd8122f-70
0.375
MAK-UNK-129dcd6f-12
0.371
MAR-TRE-04c86cea-90
0.370
MAR-TRE-2fd8122f-95
0.367
MAR-TRE-2fd8122f-40
0.363
KEI-TRE-d5e2018a-13
0.354
MAR-TRE-4b834d9a-57
0.351
MAR-TRE-2fd8122f-5
0.351
MAR-TRE-2fd8122f-76
0.348
MAR-TRE-f6f5f473-23
0.347
MAR-TRE-f6f5f473-36
0.347
MAR-TRE-2fd8122f-85
0.347
MAR-TRE-4b834d9a-67
0.347
MAR-TRE-4b834d9a-92
0.347
MAR-TRE-2fd8122f-11
0.347
MAK-UNK-c749d764-27
0.345
MAR-TRE-2fd8122f-52
0.344
MAR-TRE-2fd8122f-2
0.341
BAR-COM-4e090d3a-57
0.340
MAR-TRE-3e4e6814-45
0.340
CHR-SOS-7098f804-19
0.340
ANT-DIA-3c79be55-4
0.337
MAR-TRE-2fd8122f-31
0.337
MAR-TRE-2fd8122f-15
0.337
MAK-UNK-009ebe36-3
0.337
MAR-TRE-4b834d9a-71
0.333
SAD-SAT-135344c3-5
0.333
MAR-TRE-4b834d9a-24
0.333
MAK-UNK-129dcd6f-9
0.333
ALE-MCD-4ac17b19-1
0.333
JAN-GHE-4287bd1a-9
0.333
CHR-SOS-7098f804-22
0.330
KEI-TRE-d5e2018a-53
0.330
MAR-TRE-92684b97-25
0.330
MAR-TRE-2fd8122f-98
0.330
MAK-UNK-ca11b4f7-3
0.329
MAR-TRE-f6f5f473-58
0.327
CHR-SOS-70e4c98a-5
0.326
JOH-IMS-62aeb97d-5
0.324
SAD-SAT-f25ee457-7
0.323
MAR-TRE-04c86cea-17
0.323
KEI-TRE-d5e2018a-58
0.323
MAK-UNK-009ebe36-2
0.323
KEI-TRE-d5e2018a-10
0.323
MAR-TRE-4b834d9a-43
0.323
MAR-TRE-2fd8122f-13
0.323
MAR-TRE-67513f76-51
0.320
MAR-TRE-04c86cea-35
0.320
CHR-SOS-7098f804-15
0.319
MAK-UNK-10dfa458-31
0.319
WAR-XCH-eb7b662f-6
0.317
DAR-DIA-842b4336-3
0.317
KEI-TRE-d5e2018a-61
0.316
MAR-TRE-2fd8122f-6
0.316
MAR-TRE-3e4e6814-92
0.316
MAR-TRE-04c86cea-46
0.316
MAK-UNK-c749d764-9
0.316
CHR-SOS-7098f804-18
0.315
MAR-TRE-67513f76-81
0.315
MAR-TRE-d0525fbf-14
0.313
KEI-TRE-d5e2018a-9
0.313
KEI-TRE-d5e2018a-79
0.313
MAK-UNK-129dcd6f-4
0.312
SAN-PRS-52b81272-2
0.312
HUB-UNK-9845d277-14
0.312
MAR-TRE-2fd8122f-41
0.311
MAR-TRE-d0525fbf-90
0.311
MAK-UNK-ca11b4f7-2
0.311
SAD-SAT-cefd50cc-1
0.310
ALE-HEI-f28a35b5-4
0.310
SAD-SAT-135344c3-4
0.309
MAR-TRE-b77b7921-70
0.309
KEI-TRE-d5e2018a-52
0.309
MAK-UNK-ca11b4f7-1
0.307
MAR-TRE-2fd8122f-56
0.306