Molecular Properties | |
SMILES: | Cc1cc(C(=O)Nc2cccnc2)c(C)n1Cc1ccc(S(N)(=O)=O)cc1 |
MW: | 384.13 |
Fraction sp3: | 0.16 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 5 |
TPSA: | 107.08 |
cLogP: | 2.45 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z194863174 |
CHR-SOS-7098f804-15
0.512
CHA-MCP-85291e1d-2
0.429
CHR-SOS-7098f804-19
0.415
KEI-TRE-d5e2018a-10
0.413
MAR-TRE-799db12b-6
0.409
KEI-TRE-d5e2018a-13
0.400
MAR-TRE-2fd8122f-85
0.394
MAR-TRE-2fd8122f-70
0.392
CHA-MCP-85291e1d-5
0.391
KEI-TRE-d5e2018a-61
0.389
CHR-SOS-7098f804-11
0.386
CHR-SOS-70e4c98a-11
0.385
CHR-SOS-7098f804-17
0.384
SAD-SAT-f25ee457-7
0.383
MAR-TRE-2fd8122f-37
0.382
MAR-TRE-2fd8122f-82
0.380
CHR-SOS-70e4c98a-2
0.375
CHR-SOS-7098f804-14
0.375
MAR-TRE-2fd8122f-52
0.375
KEI-TRE-d5e2018a-53
0.374
MAR-TRE-f6f5f473-75
0.372
MAR-TRE-2fd8122f-78
0.372
ANT-DIA-3c79be55-4
0.372
KEI-TRE-d5e2018a-9
0.371
MAR-TRE-2fd8122f-84
0.371
MAR-TRE-2fd8122f-58
0.371
MAR-TRE-2fd8122f-95
0.370
CHR-SOS-70e4c98a-7
0.368
CHA-MCP-85291e1d-4
0.367
SAD-SAT-f25ee457-8
0.367
KEI-TRE-d5e2018a-100
0.365
TAM-UNI-c140e31a-14
0.364
CHR-SOS-70e4c98a-9
0.361
CHR-SOS-7098f804-22
0.360
CHR-SOS-70e4c98a-12
0.360
MAK-UNK-a7b37c5e-4
0.358
CHR-SOS-e960e883-3
0.358
EDG-MED-0da5ad92-2
0.357
CHR-SOS-e960e883-1
0.357
KEI-TRE-d5e2018a-70
0.357
MAR-TRE-f6f5f473-79
0.354
KEI-TRE-d5e2018a-86
0.354
MAR-TRE-04c86cea-65
0.354
CHR-SOS-70e4c98a-4
0.354
TAM-UNI-c140e31a-7
0.354
TAM-UNI-c140e31a-12
0.354
MAR-TRE-2fd8122f-55
0.353
KEI-TRE-d5e2018a-44
0.352
CHR-SOS-7098f804-13
0.352
SAD-SAT-135344c3-10
0.351
MAR-TRE-2fd8122f-76
0.351
KEI-TRE-d5e2018a-91
0.351
MAR-TRE-67513f76-51
0.351
CHR-SOS-e960e883-2
0.351
MAR-TRE-2fd8122f-24
0.351
SAN-PRS-52b81272-2
0.350
TAM-UNI-c140e31a-6
0.350
MAR-TRE-2fd8122f-98
0.348
TAM-UNI-c140e31a-13
0.347
MAR-TRE-3e4e6814-92
0.347
MAR-TRE-2fd8122f-25
0.346
KEI-TRE-d5e2018a-32
0.344
MAR-TRE-3e4e6814-34
0.344
MAR-TRE-2fd8122f-21
0.344
MAR-TRE-2fd8122f-73
0.343
GAB-REV-70cc3ca5-20
0.341
KEI-TRE-d5e2018a-28
0.340
MAR-TRE-f6f5f473-29
0.340
MAR-TRE-2fd8122f-15
0.340
MAK-UNK-a7b37c5e-5
0.337
MAR-TRE-2fd8122f-35
0.337
CHA-MCP-85291e1d-1
0.333
MAR-TRE-2fd8122f-65
0.333
KEI-TRE-d5e2018a-50
0.333
ADA-UNI-f8e79267-8
0.333
SAD-SAT-135344c3-2
0.333
CHR-SOS-7098f804-12
0.333
KEI-TRE-d5e2018a-78
0.330
TAM-UNI-c140e31a-1
0.330
KEI-TRE-d5e2018a-84
0.330
KEI-TRE-d5e2018a-71
0.330
KEI-TRE-d5e2018a-82
0.330
ADA-UNI-f8e79267-9
0.330
MAR-TRE-2fd8122f-64
0.330
MAR-TRE-04c86cea-90
0.330
KEI-TRE-d5e2018a-36
0.330
KEI-TRE-d5e2018a-22
0.330
MAR-TRE-3e4e6814-45
0.330
MAR-TRE-2fd8122f-2
0.330
JOH-IMS-62aeb97d-3
0.329
DAR-DIA-23aa0b97-16
0.329
KEI-TRE-d5e2018a-90
0.329
JOH-IMS-62aeb97d-5
0.329
MAK-UNK-ca11b4f7-1
0.329
KEI-TRE-d5e2018a-75
0.327
MAR-TRE-2fd8122f-83
0.327
KEI-TRE-d5e2018a-88
0.327
MAR-TRE-74c6519b-56
0.327
MAR-TRE-2fd8122f-4
0.327
KEI-TRE-d5e2018a-52
0.327