Molecular Properties | |
SMILES: | CS(=O)(=O)NCCCc1ccc(Cl)cc1NC(=O)Nc1cccnc1 |
MW: | 382.873 |
Fraction sp3: | 0.25 |
HBA: | 4 |
HBD: | 3 |
Rotatable Bonds: | 7 |
TPSA: | 100.19 |
cLogP: | 2.8608 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Aliphatic long chain
Hetero_hetero
WAR-XCH-6eb0722e-4
0.797
WAR-XCH-6eb0722e-6
0.731
WAR-XCH-6eb0722e-3
0.704
WAR-XCH-6eb0722e-5
0.571
WAR-XCH-6eb0722e-1
0.558
ADA-UNI-f8e79267-8
0.446
MAK-UNK-d1e89583-2
0.425
JIA-UNI-12b1f9ae-1
0.424
WAR-XCH-eb7b662f-7
0.418
JOR-UNI-2fc98d0b-7
0.418
JAN-GHE-83b26c96-19
0.418
DAR-DIA-23aa0b97-14
0.418
BAR-COM-5694a99d-1
0.418
MAK-UNK-d1e89583-4
0.412
BAR-COM-5694a99d-4
0.411
ADA-UNI-f8e79267-7
0.411
WAR-XCH-eb7b662f-3
0.410
DAR-DIA-23aa0b97-16
0.407
DAR-DIA-23aa0b97-15
0.405
SER-UNI-985a0e14-1
0.398
WAR-XCH-eb7b662f-5
0.398
MAK-UNK-d1e89583-7
0.395
SAD-SAT-f25ee457-7
0.394
SAD-SAT-689b7d5a-8
0.393
MAD-FNM-74857450-1
0.392
BAR-COM-5694a99d-3
0.391
BAR-COM-5694a99d-5
0.387
WAR-XCH-eb7b662f-4
0.386
EDG-MED-0da5ad92-2
0.386
SAD-SAT-689b7d5a-5
0.385
ADA-UNI-f8e79267-2
0.385
BEN-DND-362d364a-12
0.382
DRE-WAB-ae4a693c-1
0.382
PET-SGC-d0156db4-1
0.382
IAN-BAS-df1706d7-1
0.382
PET-SGC-b0f8bd49-1
0.382
AAR-POS-d2a4d1df-11
0.382
PET-SGC-d0156db4-2
0.380
BAR-COM-5694a99d-2
0.376
ASH-UNK-40b46b30-7
0.376
MAK-UNK-d1e89583-8
0.375
DUN-NEW-f8ce3686-4
0.373
DAR-DIA-842b4336-2
0.370
MAK-UNK-a7b37c5e-4
0.370
ASH-UNK-40b46b30-13
0.370
DAR-DIA-842b4336-7
0.369
DAR-DIA-842b4336-8
0.369
ZAC-WAB-d55a3c2e-2
0.368
KEI-TRE-d5e2018a-76
0.368
ZAC-WAB-3baddbb3-1
0.368
WAR-XCH-eb7b662f-2
0.368
ADA-UNI-f8e79267-9
0.367
DAR-DIA-842b4336-4
0.366
WAR-XCH-eb7b662f-6
0.366
ADA-UNI-f8e79267-1
0.366
JOR-UNI-61e7b1d5-1
0.366
DAR-DIA-842b4336-1
0.362
SAD-SAT-135344c3-6
0.362
KEI-TRE-d5e2018a-19
0.362
MAK-UNK-ca11b4f7-1
0.360
MAR-TRE-4b834d9a-79
0.359
SAD-SAT-cefd50cc-1
0.356
MAK-UNK-c749d764-14
0.356
TAM-UNI-c140e31a-10
0.355
KEI-TRE-d5e2018a-47
0.354
MAK-UNK-d1e89583-1
0.354
KEI-TRE-d5e2018a-84
0.354
WIL-UNI-5578df48-21
0.353
MAK-UNK-d1e89583-3
0.352
ASH-UNK-40b46b30-3
0.352
MAR-TRE-67513f76-32
0.352
KEI-TRE-d5e2018a-99
0.352
KEI-TRE-d5e2018a-89
0.351
MAK-UNK-129dcd6f-5
0.351
KEI-TRE-d5e2018a-16
0.351
ALE-HEI-f28a35b5-15
0.350
DAR-DIA-842b4336-3
0.349
CHR-SOS-7098f804-11
0.349
MAK-UNK-d1e89583-9
0.348
TAM-UNI-c140e31a-19
0.348
MAK-UNK-37f1d6fa-1
0.348
SAD-SAT-f25ee457-8
0.348
ADA-UNI-f8e79267-11
0.347
STE-LAU-aafa5dff-1
0.347
ALE-MCD-4ac17b19-1
0.347
LON-WEI-5e7d1b3e-22
0.347
LON-WEI-4d77710c-22
0.347
SAD-SAT-689b7d5a-1
0.347
MAR-TRE-2fd8122f-98
0.344
WIL-UNI-5578df48-26
0.344
BAR-COM-21d20d65-5
0.344
JOH-IMS-62aeb97d-5
0.342
ALE-HEI-f28a35b5-4
0.341
MAK-UNK-a7b37c5e-1
0.341
MAK-UNK-c749d764-17
0.341
DAR-DIA-842b4336-6
0.341
BEN-DND-61647d40-18
0.341
WIL-UNI-5578df48-19
0.341
CHR-SOS-7098f804-14
0.341
WIL-UNI-5578df48-14
0.341