Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(S(=O)(=O)c2ccncc2)CC1 |
MW: | 303.04 |
Fraction sp3: | 0.45 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 70.58 |
cLogP: | 0.15 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Hetero_hetero
MAR-TRE-6a44bbf2-21
0.654
MAK-UNK-7c9d1431-9
0.654
AAR-POS-d2a4d1df-44
0.642
DRR-IMP-dff87f5e-3
0.642
KAY-MCD-d0fe5261-1
0.630
AAR-POS-d2a4d1df-27
0.630
MAR-TRE-6a44bbf2-68
0.630
DRR-IMP-dff87f5e-1
0.630
MAR-TRE-6a44bbf2-58
0.630
DRR-IMP-dff87f5e-7
0.630
MAR-LAB-efb042c5-5
0.630
PEI-IMP-ca0b2813-1
0.625
DRR-IMP-dff87f5e-6
0.625
MAR-TRE-6a44bbf2-78
0.618
MAK-UNK-7c9d1431-13
0.618
SAD-SAT-3a925b8b-2
0.600
MAK-UNK-c74072e5-8
0.596
DRR-IMP-dff87f5e-9
0.596
MAK-UNK-7c9d1431-6
0.596
MAK-UNK-7c9d1431-17
0.596
JAY-UNK-11f5bdbd-1
0.589
MAK-UNK-d4768348-4
0.571
MAT-POS-ee51dedd-2
0.571
MAK-UNK-7c9d1431-8
0.569
MAR-TRE-6a44bbf2-26
0.569
MAK-UNK-7c9d1431-22
0.567
SAD-SAT-bc31ec01-5
0.554
MAR-TRE-6a44bbf2-18
0.552
LON-WEI-8f408cad-4
0.552
AAR-POS-d2a4d1df-23
0.552
BEN-DND-03406596-10
0.552
BAP-BUY-55f8bcae-1
0.548
NIM-UNI-310206f0-69
0.538
MAR-TRE-6a44bbf2-32
0.533
MAK-UNK-7c9d1431-10
0.533
DRR-IMP-dff87f5e-8
0.533
ABB-MCD-f8003a30-1
0.533
MAK-UNK-7c9d1431-11
0.532
MAK-UNK-7c9d1431-19
0.532
MAR-TRE-6a44bbf2-65
0.532
TAT-ENA-80bfd3e5-43
0.532
AAR-POS-d2a4d1df-22
0.517
LON-WEI-8f408cad-3
0.517
MAR-TRE-6a44bbf2-52
0.517
DRR-IMP-dff87f5e-4
0.509
SAD-SAT-3a925b8b-3
0.508
MAK-UNK-d4768348-8
0.508
MAK-UNK-d4768348-5
0.508
SAD-SAT-bc31ec01-4
0.508
BEN-DND-03406596-8
0.508
MAK-UNK-d4768348-3
0.500
MAK-UNK-d4768348-7
0.500
IND-SYN-6c8299e8-2
0.492
MAK-UNK-7c9d1431-3
0.492
PEI-IMP-ca0b2813-3
0.492
MAK-UNK-7c9d1431-4
0.492
TAT-ENA-80bfd3e5-25
0.492
DRR-IMP-dff87f5e-2
0.492
AAR-POS-0daf6b7e-15
0.492
SAD-SAT-3a925b8b-9
0.492
MAK-UNK-d4768348-1
0.492
MAR-TRE-6a44bbf2-49
0.485
MAR-TRE-6a44bbf2-31
0.485
MAK-UNK-7c9d1431-5
0.485
MAK-UNK-7c9d1431-7
0.485
MAR-TRE-6a44bbf2-4
0.483
MAK-UNK-7c9d1431-12
0.483
AAR-POS-d2a4d1df-32
0.483
NIM-UNI-05f93fcc-1
0.483
LON-WEI-8f408cad-2
0.483
MAK-UNK-7c9d1431-1
0.478
MAR-TRE-6a44bbf2-38
0.478
DRR-IMP-38dce17f-6
0.474
MAR-TRE-6a44bbf2-8
0.468
AAR-POS-d2a4d1df-34
0.468
DRR-IMP-dff87f5e-5
0.468
DRR-IMP-db50bf6e-5
0.467
MAK-UNK-7c9d1431-2
0.464
MAR-TRE-6a44bbf2-36
0.464
MAR-TRE-6a44bbf2-45
0.463
MAK-UNK-7c9d1431-30
0.463
MAK-UNK-d4768348-9
0.462
SAD-SAT-3a925b8b-7
0.460
SAD-SAT-3a925b8b-6
0.459
MAK-UNK-d4768348-2
0.459
SAD-SAT-f2e2579e-5
0.457
DRR-IMP-db50bf6e-4
0.455
MED-COV-4280ac29-5
0.453
AAR-POS-d2a4d1df-36
0.453
AAR-POS-0daf6b7e-3
0.453
RHE-UNK-eb059eb9-1
0.453
MAR-TRE-6a44bbf2-13
0.453
WAR-XCH-79d12f6e-6
0.453
MAR-TRE-6a44bbf2-24
0.452
BEN-DND-76ad4ac9-14
0.448
BEN-DND-03406596-3
0.448
KAT-UNK-b2a0d5b1-1
0.446
PEI-IMP-ca0b2813-4
0.444
SAD-SAT-9a6c5cf3-5
0.444
NIM-UNI-05f93fcc-6
0.444