Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2)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-7c9d1431-10
0.722
MAR-TRE-6a44bbf2-26
0.643
MAK-UNK-7c9d1431-8
0.643
MAR-TRE-6a44bbf2-32
0.632
DRR-IMP-dff87f5e-8
0.632
ABB-MCD-f8003a30-1
0.632
DRR-IMP-dff87f5e-3
0.630
AAR-POS-d2a4d1df-44
0.630
BEN-DND-03406596-10
0.625
LON-WEI-8f408cad-4
0.625
AAR-POS-d2a4d1df-23
0.625
MAR-TRE-6a44bbf2-18
0.625
DRR-IMP-dff87f5e-7
0.618
MAK-UNK-7c9d1431-19
0.600
SAD-SAT-bc31ec01-5
0.600
PEI-IMP-ca0b2813-2
0.589
KAY-MCD-d0fe5261-1
0.589
AAR-POS-d2a4d1df-27
0.589
MAR-LAB-efb042c5-5
0.589
MAR-TRE-6a44bbf2-58
0.589
MAR-TRE-6a44bbf2-68
0.589
DRR-IMP-dff87f5e-1
0.589
MAR-TRE-6a44bbf2-38
0.587
MAK-UNK-7c9d1431-1
0.587
MAK-UNK-7c9d1431-17
0.586
MAK-UNK-7c9d1431-22
0.583
MAR-TRE-6a44bbf2-21
0.582
MAK-UNK-7c9d1431-9
0.582
DRR-IMP-dff87f5e-4
0.582
MAK-UNK-7c9d1431-3
0.581
TAT-ENA-80bfd3e5-25
0.581
MAK-UNK-7c9d1431-4
0.581
DRR-IMP-dff87f5e-2
0.581
MAR-TRE-6a44bbf2-78
0.579
MAK-UNK-7c9d1431-13
0.579
MAR-TRE-6a44bbf2-65
0.574
TAT-ENA-80bfd3e5-43
0.574
MAK-UNK-7c9d1431-11
0.574
MAR-TRE-6a44bbf2-49
0.571
MAK-UNK-7c9d1431-7
0.571
MAR-TRE-6a44bbf2-31
0.571
MAK-UNK-7c9d1431-5
0.571
MAR-TRE-6a44bbf2-36
0.569
MAK-UNK-7c9d1431-2
0.569
MAT-POS-ee51dedd-2
0.561
DRR-IMP-db50bf6e-5
0.561
SAD-SAT-3a925b8b-2
0.561
PEI-IMP-ca0b2813-1
0.559
MAK-UNK-7c9d1431-6
0.559
DRR-IMP-dff87f5e-6
0.559
DRR-IMP-dff87f5e-9
0.559
MAK-UNK-c74072e5-8
0.559
PEI-IMP-ca0b2813-3
0.556
IND-SYN-6c8299e8-2
0.556
SAD-SAT-bc31ec01-4
0.550
BAP-BUY-55f8bcae-1
0.540
BEN-DND-03406596-3
0.531
BEN-DND-76ad4ac9-14
0.531
SAD-SAT-3a925b8b-3
0.525
SAD-SAT-3a925b8b-9
0.508
MAK-UNK-d4768348-4
0.508
AAR-POS-0daf6b7e-15
0.508
MAK-UNK-7c9d1431-12
0.500
BEN-DND-03406596-8
0.500
LON-WEI-8f408cad-2
0.500
MAR-TRE-6a44bbf2-4
0.500
AAR-POS-d2a4d1df-32
0.500
NIM-UNI-05f93fcc-1
0.500
MAK-UNK-d4768348-5
0.500
MAK-UNK-c74072e5-9
0.486
AAR-POS-d2a4d1df-22
0.483
LON-WEI-8f408cad-3
0.483
MAR-TRE-6a44bbf2-52
0.483
MAK-UNK-d4768348-1
0.483
MAR-TRE-6a44bbf2-45
0.478
MAK-UNK-7c9d1431-30
0.478
MAK-UNK-d4768348-8
0.475
SAD-SAT-3a925b8b-6
0.475
MAR-TRE-6a44bbf2-13
0.469
AAR-POS-d2a4d1df-36
0.469
WAR-XCH-79d12f6e-6
0.469
RHE-UNK-eb059eb9-1
0.469
AAR-POS-0daf6b7e-3
0.469
MAR-TRE-6a44bbf2-24
0.468
DAN-MCD-50ec7d1f-1
0.468
MAK-UNK-d4768348-3
0.468
MAK-UNK-d4768348-7
0.468
KAT-UNK-b2a0d5b1-1
0.462
DRR-IMP-dff87f5e-5
0.460
AAR-POS-d2a4d1df-34
0.460
MAR-TRE-6a44bbf2-8
0.460
SAD-SAT-3a925b8b-7
0.453
MAK-UNK-d4768348-2
0.452
AHN-SAT-de2502ba-19
0.446
SAD-SAT-9a6c5cf3-6
0.436
NIM-UNI-05f93fcc-11
0.435
AAR-POS-d2a4d1df-37
0.433
MAR-TRE-6a44bbf2-7
0.433
MAK-UNK-d4768348-9
0.433
AHN-SAT-de2502ba-17
0.433