Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1 |
MW: | 369.97 |
Fraction sp3: | 0.42 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 2.07 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activated haloaromatics
Hetero_hetero
MAK-UNK-7c9d1431-9
DRR-IMP-db50bf6e-5
0.654
MAR-TRE-6a44bbf2-4
0.642
AAR-POS-d2a4d1df-32
0.642
LON-WEI-8f408cad-2
0.642
JAY-UNK-11f5bdbd-1
0.582
MAK-UNK-7c9d1431-12
0.582
MAR-TRE-6a44bbf2-52
0.564
LON-WEI-8f408cad-3
0.564
AAR-POS-0daf6b7e-15
0.564
AAR-POS-d2a4d1df-22
0.564
MAK-UNK-7c9d1431-9
0.556
MAR-TRE-6a44bbf2-21
0.556
DRR-IMP-dff87f5e-8
0.552
AAR-POS-d2a4d1df-44
0.545
DRR-IMP-dff87f5e-3
0.545
BEN-DND-03406596-10
0.544
LON-WEI-8f408cad-4
0.544
MAR-TRE-6a44bbf2-18
0.544
AAR-POS-d2a4d1df-23
0.544
NIM-UNI-05f93fcc-1
0.526
MAK-UNK-7c9d1431-10
0.525
MAR-TRE-6a44bbf2-65
0.525
MAK-UNK-7c9d1431-11
0.525
TAT-ENA-80bfd3e5-43
0.525
SAD-SAT-bc31ec01-5
0.518
MAR-TRE-6a44bbf2-24
0.517
BEN-DND-03406596-2
0.516
BEN-DND-76ad4ac9-12
0.516
MAT-POS-ee51dedd-2
0.509
MAR-TRE-6a44bbf2-68
0.509
DRR-IMP-dff87f5e-7
0.509
SAD-SAT-3a925b8b-2
0.509
SAD-SAT-3a925b8b-9
0.509
DRR-IMP-dff87f5e-1
0.509
MAR-TRE-6a44bbf2-58
0.509
AAR-POS-d2a4d1df-27
0.509
MAR-LAB-efb042c5-5
0.509
KAY-MCD-d0fe5261-1
0.509
PEI-IMP-ca0b2813-2
0.509
AAR-POS-d2a4d1df-34
0.508
DRR-IMP-dff87f5e-5
0.508
MAR-TRE-6a44bbf2-8
0.508
PEI-IMP-ca0b2813-1
0.508
IND-SYN-6c8299e8-2
0.508
MAK-UNK-7c9d1431-13
0.500
SAD-SAT-3a925b8b-6
0.500
MAR-TRE-6a44bbf2-78
0.500
MAK-UNK-d4768348-2
0.500
NIM-UNI-05f93fcc-3
0.500
NIM-UNI-05f93fcc-2
0.492
DRR-IMP-db50bf6e-4
0.492
AAR-POS-d2a4d1df-36
0.492
TAT-ENA-80bfd3e5-25
0.484
PEI-IMP-ca0b2813-3
0.484
MAK-UNK-7c9d1431-4
0.484
MAK-UNK-7c9d1431-22
0.484
MAK-UNK-7c9d1431-6
0.483
MAK-UNK-7c9d1431-17
0.483
DRR-IMP-dff87f5e-6
0.483
DRR-IMP-dff87f5e-9
0.483
MAK-UNK-c74072e5-8
0.483
MAK-UNK-7c9d1431-8
0.483
MAR-TRE-6a44bbf2-26
0.483
MAK-UNK-d4768348-4
0.483
MAK-UNK-d4768348-1
0.483
NIM-UNI-05f93fcc-11
0.477
MAR-TRE-6a44bbf2-7
0.476
AAR-POS-d2a4d1df-37
0.476
SAD-SAT-bc31ec01-4
0.475
ABB-MCD-f8003a30-1
0.475
MAR-TRE-6a44bbf2-32
0.475
MAK-UNK-d4768348-8
0.475
SAD-SAT-3a925b8b-3
0.475
MAK-UNK-d4768348-5
0.475
DRR-IMP-38dce17f-1
0.474
BEN-DND-76ad4ac9-13
0.469
BEN-DND-03406596-5
0.469
MAR-TRE-6a44bbf2-13
0.468
RHE-UNK-eb059eb9-1
0.468
AAR-POS-0daf6b7e-3
0.468
WAR-XCH-79d12f6e-6
0.468
MAK-UNK-d4768348-3
0.467
MAK-UNK-d4768348-7
0.467
SAD-SAT-f2e2579e-3
0.464
NIM-UNI-310206f0-69
0.463
NIM-UNI-05f93fcc-14
0.463
DRR-IMP-dff87f5e-2
0.462
BEN-DND-76ad4ac9-14
0.462
MAK-UNK-7c9d1431-3
0.462
BEN-DND-03406596-3
0.462
KAT-UNK-b2a0d5b1-1
0.460
MAK-UNK-7c9d1431-27
0.459
MAK-UNK-7c9d1431-5
0.455
MAR-TRE-6a44bbf2-31
0.455
MAR-TRE-6a44bbf2-49
0.455
MAK-UNK-7c9d1431-7
0.455
MAK-UNK-7c9d1431-19
0.453
SAD-SAT-3a925b8b-7
0.452
MAK-UNK-7c9d1431-23
0.450
MAR-TRE-6a44bbf2-28
0.450