Molecular Properties | |
SMILES: | NS(=O)(=O)c1cc(Cl)cc(C(=O)N2CCN(C(=O)CCl)CC2)c1 |
MW: | 379.02 |
Fraction sp3: | 0.38 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 100.78 |
cLogP: | 0.51 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
AAR-POS-d2a4d1df-1
SAD-SAT-581007d4-5
0.603
SAD-SAT-581007d4-3
0.538
MAK-UNK-6ca90168-15
0.508
DRR-IMP-db50bf6e-3
0.492
MAK-UNK-6ca90168-20
0.459
MAK-UNK-987948f6-2
0.450
ASH-SAT-43770c7d-10
0.438
SAD-SAT-bc31ec01-5
0.438
SAD-SAT-3a925b8b-5
0.435
AAR-POS-d2a4d1df-25
0.435
AHN-SAT-de2502ba-8
0.435
DRR-IMP-db50bf6e-1
0.435
SAD-SAT-581007d4-4
0.429
MAK-UNK-987948f6-3
0.415
SAD-SAT-1b030f84-5
0.406
DRR-IMP-db50bf6e-2
0.406
SAD-SAT-1b030f84-8
0.404
PAU-UNI-8cdd41c7-1
0.391
SAD-SAT-1b030f84-9
0.388
DRR-IMP-dff87f5e-8
0.386
MAK-UNK-7c9d1431-10
0.386
SAD-SAT-bc31ec01-4
0.386
AAR-POS-0daf6b7e-16
0.385
SEL-UNI-cd366922-7
0.377
DRR-IMP-dff87f5e-3
0.373
AAR-POS-d2a4d1df-44
0.373
MED-COV-4280ac29-33
0.370
SAD-SAT-3a925b8b-4
0.369
AAR-POS-d2a4d1df-29
0.369
MAR-TRE-6a44bbf2-61
0.369
JOH-UNI-27ac80fd-25
0.364
MAK-UNK-704ed37c-11
0.364
SAD-SAT-3a925b8b-1
0.364
SAD-SAT-581007d4-1
0.362
SAD-SAT-581007d4-2
0.362
MAT-POS-2db6411e-2
0.362
JAY-UNK-11f5bdbd-1
0.362
SAD-SAT-581007d4-7
0.362
MAK-UNK-6ca90168-17
0.362
MAK-UNK-7c9d1431-29
0.354
MAK-UNK-7c9d1431-11
0.351
TAT-ENA-80bfd3e5-43
0.351
MAR-TRE-6a44bbf2-65
0.351
LON-WEI-8f408cad-3
0.348
AAR-POS-0daf6b7e-15
0.348
HYO-UNK-49a60884-1
0.348
MAR-TRE-6a44bbf2-68
0.348
MED-COV-4280ac29-15
0.348
MAR-TRE-6a44bbf2-52
0.348
MAR-LAB-efb042c5-5
0.348
AAR-POS-d2a4d1df-27
0.348
AAR-POS-d2a4d1df-22
0.348
AAR-POS-d2a4d1df-35
0.348
JOH-UNI-0e1753c1-3
0.348
DRR-IMP-db50bf6e-5
0.348
MAR-TRE-6a44bbf2-32
0.347
ABB-MCD-f8003a30-1
0.347
MIH-UNI-e573136b-4
0.346
AAR-POS-0daf6b7e-21
0.345
MAK-UNK-7c9d1431-13
0.343
SAD-SAT-89668ff1-8
0.343
MAR-TRE-6a44bbf2-78
0.343
NIR-THE-0d6461ce-5
0.341
HAR-NEW-e34cb1ae-5
0.341
JOK-SYG-6ec557d2-1
0.341
MAK-UNK-6ca90168-18
0.339
DRR-IMP-dff87f5e-4
0.338
SAD-SAT-65574d3f-9
0.338
MAK-UNK-6ca90168-10
0.338
MAK-UNK-7c9d1431-9
0.338
MAR-TRE-6a44bbf2-21
0.338
LON-WEI-8f408cad-4
0.338
BEN-DND-03406596-10
0.338
MAR-TRE-6a44bbf2-18
0.338
AAR-POS-d2a4d1df-23
0.338
SAD-SAT-581007d4-10
0.338
DAR-DIA-fb20be43-9
0.337
DAR-DIA-fb20be43-12
0.337
SWA-SYN-40d44a84-2
0.337
MAR-TRE-6a44bbf2-26
0.333
BEN-DND-76ad4ac9-8
0.333
MAK-UNK-7c9d1431-8
0.333
MAK-UNK-af83ef51-17
0.330
YOI-UNK-090ea88a-1
0.329
DRR-IMP-dff87f5e-7
0.329
SAD-SAT-3a925b8b-2
0.329
SAD-SAT-3a925b8b-9
0.329
PEI-IMP-ca0b2813-2
0.329
DRR-IMP-dff87f5e-1
0.329
KAY-MCD-d0fe5261-1
0.329
MAR-TRE-6a44bbf2-58
0.329
MAT-POS-ee51dedd-2
0.329
MAK-UNK-d4768348-4
0.329
JOK-SYG-302da050-2
0.326
PEI-IMP-ca0b2813-3
0.325
MED-COV-4280ac29-29
0.324
MAK-UNK-6ca90168-1
0.324
SAD-SAT-3a925b8b-3
0.324
SAD-SAT-5b1897b2-8
0.324
SAD-SAT-3a925b8b-6
0.324