Molecular Properties | |
SMILES: | COc1ccccc1CNS(=O)(=O)c1cc(C(=O)Nc2cccnc2)c(Cl)cc1Cl |
MW: | 465.03 |
Fraction sp3: | 0.1 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 7 |
TPSA: | 97.39 |
cLogP: | 4.13 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activated haloaromatics
Hetero_hetero
MAR-TRE-2fd8122f-86
0.435
MAR-TRE-2fd8122f-95
0.387
MAR-TRE-2fd8122f-40
0.382
MAR-TRE-2fd8122f-11
0.380
MAR-TRE-2fd8122f-52
0.379
KEI-TRE-d5e2018a-53
0.377
KEI-TRE-d5e2018a-54
0.373
KEI-TRE-d5e2018a-44
0.371
MAR-TRE-2fd8122f-85
0.369
MAR-TRE-2fd8122f-70
0.368
KEI-TRE-d5e2018a-59
0.367
KEI-TRE-d5e2018a-98
0.364
KEI-TRE-d5e2018a-70
0.362
MAR-TRE-7f7bb9f0-6
0.359
MAR-TRE-2fd8122f-55
0.358
MAR-TRE-4b834d9a-79
0.355
MAK-UNK-a7b37c5e-1
0.352
KEI-TRE-d5e2018a-50
0.351
CHR-SOS-7098f804-14
0.351
ADA-UNI-f8e79267-7
0.349
KEI-TRE-d5e2018a-89
0.347
CHR-SOS-7098f804-16
0.347
KEI-TRE-d5e2018a-56
0.346
MAR-TRE-2fd8122f-5
0.346
MAK-UNK-a7b37c5e-2
0.344
CHR-SOS-7098f804-11
0.344
CHR-SOS-7098f804-13
0.343
CHR-SOS-7098f804-15
0.343
BAR-COM-5694a99d-3
0.343
WAR-XCH-6eb0722e-4
0.340
KEI-TRE-d5e2018a-64
0.339
KEI-TRE-d5e2018a-80
0.337
MAR-TRE-f6f5f473-75
0.337
KEI-TRE-d5e2018a-13
0.336
MAR-TRE-2fd8122f-84
0.336
KEI-TRE-d5e2018a-87
0.336
MAR-TRE-04c86cea-53
0.336
KEI-TRE-d5e2018a-10
0.333
KEI-TRE-d5e2018a-93
0.333
SAD-SAT-135344c3-3
0.333
MAR-TRE-2fd8122f-4
0.333
ADA-UNI-f8e79267-1
0.333
MAR-TRE-04c86cea-65
0.333
MAR-TRE-2fd8122f-35
0.330
KEI-TRE-d5e2018a-33
0.327
MAR-TRE-d0525fbf-77
0.327
MAR-TRE-3e4e6814-50
0.327
KEI-TRE-d5e2018a-39
0.325
CHR-SOS-7098f804-17
0.324
KEI-TRE-d5e2018a-82
0.324
SAD-SAT-135344c3-1
0.324
MAR-TRE-3e4e6814-6
0.324
ADA-UNI-f8e79267-10
0.324
KEI-TRE-d5e2018a-34
0.324
MAR-TRE-67513f76-93
0.323
KEI-TRE-d5e2018a-75
0.321
KEI-TRE-d5e2018a-86
0.321
MAR-TRE-fd17a9b8-90
0.321
MAR-TRE-f6f5f473-79
0.321
ANT-DIA-3c79be55-4
0.320
WIL-UNI-5578df48-22
0.320
EDG-MED-0da5ad92-2
0.319
WAR-XCH-6eb0722e-2
0.318
KEI-TRE-d5e2018a-2
0.318
MAR-TRE-2fd8122f-76
0.317
BAR-COM-5694a99d-2
0.317
SAD-SAT-689b7d5a-8
0.317
KEI-TRE-d5e2018a-18
0.316
MAR-TRE-2fd8122f-1
0.315
KEI-TRE-d5e2018a-61
0.315
JIA-UNI-12b1f9ae-1
0.313
MAK-UNK-d1e89583-8
0.313
KEI-TRE-d5e2018a-78
0.313
KEI-TRE-d5e2018a-71
0.312
KEI-TRE-d5e2018a-84
0.312
KEI-TRE-d5e2018a-9
0.312
MAR-TRE-2fd8122f-73
0.312
WAR-XCH-6eb0722e-1
0.312
MAK-UNK-d1e89583-7
0.312
CHR-SOS-7098f804-12
0.312
SAD-SAT-689b7d5a-5
0.311
CHA-MCP-85291e1d-5
0.310
MAD-FNM-74857450-1
0.309
DAR-DIA-23aa0b97-16
0.309
KEI-TRE-d5e2018a-4
0.308
KEI-TRE-d5e2018a-16
0.308
MAR-TRE-4b834d9a-43
0.308
KEI-TRE-d5e2018a-58
0.308
KEI-TRE-d5e2018a-28
0.308
MAR-TRE-f6f5f473-29
0.308
JOR-UNI-61e7b1d5-1
0.308
MAR-TRE-d0525fbf-38
0.308
BAR-COM-5694a99d-4
0.308
PET-SGC-b0f8bd49-1
0.307
DRE-WAB-ae4a693c-1
0.307
ADA-UNI-f8e79267-4
0.307
BEN-DND-362d364a-12
0.307
MAR-TRE-2fd8122f-58
0.307
PET-SGC-d0156db4-1
0.307
ASH-UNK-40b46b30-3
0.307