Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(S(=O)(=O)c2ccoc2)CC1 |
MW: | 292.03 |
Fraction sp3: | 0.5 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 70.83 |
cLogP: | 0.35 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Hetero_hetero
AAR-POS-d2a4d1df-27
MAK-UNK-7c9d1431-9
0.623
MAR-TRE-6a44bbf2-21
0.623
DRR-IMP-dff87f5e-3
0.611
AAR-POS-d2a4d1df-44
0.611
KAY-MCD-d0fe5261-1
0.600
MAR-TRE-6a44bbf2-58
0.600
DRR-IMP-dff87f5e-1
0.600
AAR-POS-d2a4d1df-27
0.600
MAR-LAB-efb042c5-5
0.600
MAR-TRE-6a44bbf2-68
0.600
PEI-IMP-ca0b2813-2
0.600
DRR-IMP-dff87f5e-7
0.600
MAK-UNK-7c9d1431-13
0.589
MAR-TRE-6a44bbf2-78
0.589
MAT-POS-ee51dedd-2
0.571
MAK-UNK-7c9d1431-6
0.569
MAK-UNK-c74072e5-8
0.569
DRR-IMP-dff87f5e-6
0.569
DRR-IMP-dff87f5e-9
0.569
MAK-UNK-7c9d1431-17
0.569
JAY-UNK-11f5bdbd-1
0.561
SAD-SAT-bc31ec01-5
0.554
LON-WEI-8f408cad-4
0.552
BEN-DND-03406596-10
0.552
MAR-TRE-6a44bbf2-18
0.552
AAR-POS-d2a4d1df-23
0.552
BAP-BUY-55f8bcae-1
0.548
MAR-TRE-6a44bbf2-26
0.542
PEI-IMP-ca0b2813-1
0.542
MAK-UNK-7c9d1431-8
0.542
MAK-UNK-7c9d1431-22
0.541
SAD-SAT-3a925b8b-3
0.534
ABB-MCD-f8003a30-1
0.533
MAR-TRE-6a44bbf2-32
0.533
SAD-SAT-bc31ec01-4
0.533
DRR-IMP-dff87f5e-8
0.533
MAK-UNK-7c9d1431-10
0.533
MAK-UNK-d4768348-1
0.517
DRR-IMP-dff87f5e-2
0.516
MAK-UNK-7c9d1431-3
0.516
DRR-IMP-dff87f5e-4
0.509
TAT-ENA-80bfd3e5-43
0.508
MAK-UNK-7c9d1431-11
0.508
MAK-UNK-7c9d1431-19
0.508
MAR-TRE-6a44bbf2-65
0.508
MAK-UNK-7c9d1431-7
0.508
MAR-TRE-6a44bbf2-49
0.508
MAR-TRE-6a44bbf2-38
0.500
MAK-UNK-d4768348-7
0.500
MAK-UNK-7c9d1431-1
0.500
TAT-ENA-80bfd3e5-25
0.492
PEI-IMP-ca0b2813-3
0.492
IND-SYN-6c8299e8-2
0.492
MAK-UNK-7c9d1431-4
0.492
MAR-TRE-6a44bbf2-52
0.492
MAK-UNK-d4768348-4
0.492
LON-WEI-8f408cad-3
0.492
AAR-POS-0daf6b7e-15
0.492
SAD-SAT-3a925b8b-9
0.492
AAR-POS-d2a4d1df-22
0.492
MAR-TRE-6a44bbf2-36
0.485
MAK-UNK-7c9d1431-2
0.485
MAK-UNK-7c9d1431-5
0.485
MAR-TRE-6a44bbf2-31
0.485
BEN-DND-03406596-8
0.484
LON-WEI-8f408cad-2
0.483
NIM-UNI-05f93fcc-1
0.483
MAK-UNK-d4768348-5
0.483
MAK-UNK-d4768348-8
0.483
MAR-TRE-6a44bbf2-4
0.483
AAR-POS-d2a4d1df-32
0.483
MAK-UNK-7c9d1431-12
0.483
MAK-UNK-d4768348-3
0.475
DRR-IMP-dff87f5e-5
0.468
AAR-POS-d2a4d1df-34
0.468
MAR-TRE-6a44bbf2-8
0.468
DRR-IMP-db50bf6e-5
0.467
AAR-POS-d2a4d1df-37
0.462
MAR-TRE-6a44bbf2-7
0.462
MAK-UNK-d4768348-2
0.459
SAD-SAT-3a925b8b-6
0.459
RHE-UNK-eb059eb9-1
0.453
MAR-TRE-6a44bbf2-13
0.453
AAR-POS-d2a4d1df-36
0.453
WAR-XCH-79d12f6e-6
0.453
AAR-POS-0daf6b7e-3
0.453
MAR-TRE-6a44bbf2-24
0.452
SAD-SAT-3a925b8b-5
0.448
BEN-DND-03406596-3
0.448
BEN-DND-76ad4ac9-14
0.448
KAT-UNK-b2a0d5b1-1
0.446
NIM-UNI-05f93fcc-3
0.443
MAR-TRE-6a44bbf2-45
0.441
MAK-UNK-7c9d1431-30
0.441
MAK-UNK-d4768348-9
0.439
SAD-SAT-3a925b8b-7
0.438
SAD-SAT-f2e2579e-5
0.437
SAD-SAT-bc31ec01-8
0.435
MED-COV-4280ac29-5
0.434
DRR-IMP-db50bf6e-4
0.433