Molecular Properties | |
SMILES: | O=C(CCl)Nc1cc(S(=O)(=O)N2CCCC2)ccc1Cl |
MW: | 336.01 |
Fraction sp3: | 0.42 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 66.48 |
cLogP: | 2.3 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine BB: | EN300-01798 |
Enamine SCR: | Z56824604 |
Mcule: | MCULE-7194953446 |
MolPort: | MolPort-002-462-870 |
Activated haloaromatics
Dye 22
Hetero_hetero
VIR-GIT-7b3d3065-2
AHN-SAT-de2502ba-17
0.923
AHN-SAT-de2502ba-18
0.923
AHN-SAT-de2502ba-16
0.741
AHN-SAT-de2502ba-10
0.603
MAR-TRE-6a44bbf2-89
0.525
AHN-SAT-de2502ba-6
0.523
MAR-TRE-6a44bbf2-43
0.523
AHN-SAT-de2502ba-5
0.485
AHN-SAT-de2502ba-9
0.478
JAY-UNK-11f5bdbd-1
0.446
MAR-TRE-6a44bbf2-22
0.419
MAK-UNK-7c9d1431-26
0.419
AHN-SAT-de2502ba-11
0.400
SAD-SAT-1f400d17-2
0.394
MAR-TRE-6a44bbf2-31
0.392
MAK-UNK-7c9d1431-5
0.392
MAK-UNK-7c9d1431-10
0.386
BEN-DND-03406596-3
0.378
BEN-DND-76ad4ac9-14
0.378
AHN-SAT-de2502ba-4
0.378
MAR-TRE-6a44bbf2-100
0.378
MAK-UNK-7c9d1431-7
0.373
MAR-TRE-6a44bbf2-49
0.373
IND-SYN-6c8299e8-9
0.373
MAR-TRE-6a44bbf2-26
0.371
MAK-UNK-7c9d1431-8
0.371
MAR-TRE-6a44bbf2-32
0.366
ABB-MCD-f8003a30-1
0.366
DRR-IMP-dff87f5e-8
0.366
MAR-TRE-6a44bbf2-36
0.359
MAK-UNK-7c9d1431-2
0.359
BEN-DND-76ad4ac9-6
0.357
BEN-DND-03406596-10
0.357
LON-WEI-8f408cad-4
0.357
AAR-POS-d2a4d1df-23
0.357
MAR-TRE-6a44bbf2-18
0.357
AAR-POS-d2a4d1df-44
0.353
DRR-IMP-dff87f5e-3
0.353
MAK-UNK-7c9d1431-19
0.351
BEN-DND-03406596-8
0.351
MAK-UNK-7c9d1431-1
0.351
MAR-TRE-6a44bbf2-38
0.351
CLI-UNI-032f7715-4
0.349
MAK-UNK-69bf97dd-1
0.349
SAD-SAT-2fd372d1-3
0.348
MAK-UNK-69bf97dd-5
0.345
MAK-UNK-7c9d1431-4
0.342
IND-SYN-6c8299e8-2
0.342
DRR-IMP-dff87f5e-2
0.342
MAK-UNK-7c9d1431-3
0.342
TAT-ENA-80bfd3e5-25
0.342
MAK-UNK-7c9d1431-22
0.338
MAK-UNK-69bf97dd-9
0.337
TAT-ENA-80bfd3e5-43
0.333
AHN-SAT-de2502ba-2
0.333
SAD-SAT-9a6c5cf3-6
0.333
MAK-UNK-7c9d1431-11
0.333
MAR-TRE-6a44bbf2-65
0.333
SAD-SAT-bc31ec01-5
0.333
MAR-TRE-6a44bbf2-30
0.333
MAK-UNK-7c9d1431-17
0.333
DRR-IMP-dff87f5e-1
0.329
KAY-MCD-d0fe5261-1
0.329
MAR-TRE-6a44bbf2-58
0.329
MAR-LAB-efb042c5-5
0.329
AAR-POS-d2a4d1df-27
0.329
MAR-TRE-6a44bbf2-68
0.329
DRR-IMP-dff87f5e-7
0.329
PEI-IMP-ca0b2813-3
0.325
MAR-TRE-6a44bbf2-78
0.324
MAK-UNK-7c9d1431-13
0.324
SAD-SAT-f2e2579e-2
0.323
AHN-SAT-de2502ba-13
0.321
MAR-TRE-6a44bbf2-83
0.321
MAK-UNK-7c9d1431-9
0.319
MAR-TRE-6a44bbf2-21
0.319
DRR-IMP-dff87f5e-4
0.319
SAD-SAT-f2e2579e-7
0.319
SAD-SAT-2fd372d1-6
0.317
MAK-UNK-c74072e5-8
0.315
MAK-UNK-7c9d1431-6
0.315
DRR-IMP-dff87f5e-6
0.315
DRR-IMP-dff87f5e-9
0.315
SAD-SAT-2ceae68f-6
0.315
SAD-SAT-9a6c5cf3-2
0.314
MAR-TRE-3e4e6814-80
0.312
SAD-SAT-bc31ec01-4
0.311
MAK-UNK-c74072e5-9
0.310
PEI-IMP-ca0b2813-2
0.310
MAT-POS-ee51dedd-2
0.310
SAD-SAT-3a925b8b-2
0.310
SAD-SAT-135344c3-2
0.310
MAR-TRE-d0525fbf-45
0.309
MAR-TRE-6a44bbf2-42
0.309
MAK-UNK-7c9d1431-12
0.306
MAC-MCD-4707377b-1
0.304
MAK-UNK-7c9d1431-30
0.304
MAR-TRE-6a44bbf2-45
0.304
IND-SYN-6c8299e8-8
0.303
SWA-SYN-6423ea73-9
0.303