Molecular Properties | |
SMILES: | Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)CC2)cc1C |
MW: | 330.08 |
Fraction sp3: | 0.5 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 1.38 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine BB: | EN300-22585 |
Enamine SCR: | Z212063000 |
Enamine REAL: | Z212063000 |
Mcule: | MCULE-1606931798 |
MolPort: | MolPort-002-470-545 |
Hetero_hetero
MAR-TRE-6a44bbf2-26
1.000
JAY-UNK-11f5bdbd-1
0.643
MAR-TRE-6a44bbf2-32
0.638
ABB-MCD-f8003a30-1
0.638
MAK-UNK-7c9d1431-19
0.633
AAR-POS-d2a4d1df-27
0.625
MAR-LAB-efb042c5-5
0.625
MAR-TRE-6a44bbf2-68
0.625
MAK-UNK-7c9d1431-10
0.610
MAR-TRE-6a44bbf2-18
0.603
AAR-POS-d2a4d1df-23
0.603
BEN-DND-03406596-10
0.603
LON-WEI-8f408cad-4
0.603
PEI-IMP-ca0b2813-3
0.587
MAK-UNK-7c9d1431-13
0.586
MAR-TRE-6a44bbf2-78
0.586
DRR-IMP-dff87f5e-8
0.583
MAK-UNK-7c9d1431-11
0.581
MAR-TRE-6a44bbf2-65
0.581
TAT-ENA-80bfd3e5-43
0.581
DRR-IMP-dff87f5e-3
0.579
AAR-POS-d2a4d1df-44
0.579
MAK-UNK-7c9d1431-1
0.569
MAR-TRE-6a44bbf2-38
0.569
MAR-TRE-6a44bbf2-58
0.569
KAY-MCD-d0fe5261-1
0.569
DRR-IMP-dff87f5e-1
0.569
DRR-IMP-dff87f5e-7
0.569
PEI-IMP-ca0b2813-2
0.569
MAK-UNK-7c9d1431-17
0.567
MAK-UNK-7c9d1431-4
0.562
DRR-IMP-dff87f5e-2
0.562
MAK-UNK-7c9d1431-3
0.562
TAT-ENA-80bfd3e5-25
0.562
MAR-TRE-6a44bbf2-21
0.561
MAK-UNK-7c9d1431-9
0.561
MAK-UNK-7c9d1431-7
0.554
MAR-TRE-6a44bbf2-49
0.554
MAR-TRE-6a44bbf2-31
0.554
MAK-UNK-7c9d1431-5
0.554
MAR-TRE-6a44bbf2-36
0.552
MAK-UNK-7c9d1431-2
0.552
SAD-SAT-bc31ec01-5
0.552
BAP-BUY-55f8bcae-1
0.547
MAT-POS-ee51dedd-2
0.542
SAD-SAT-3a925b8b-2
0.542
MAK-UNK-7c9d1431-6
0.541
DRR-IMP-dff87f5e-6
0.541
DRR-IMP-dff87f5e-9
0.541
MAK-UNK-c74072e5-8
0.541
MAK-UNK-7c9d1431-22
0.540
IND-SYN-6c8299e8-2
0.538
RHE-UNK-eb059eb9-1
0.524
AAR-POS-d2a4d1df-36
0.524
AAR-POS-0daf6b7e-3
0.524
MAR-TRE-6a44bbf2-13
0.524
WAR-XCH-79d12f6e-6
0.524
MAK-UNK-d4768348-1
0.517
PEI-IMP-ca0b2813-1
0.516
SAD-SAT-bc31ec01-4
0.508
MAK-UNK-7c9d1431-30
0.507
MAR-TRE-6a44bbf2-45
0.507
BEN-DND-76ad4ac9-14
0.493
BEN-DND-03406596-3
0.493
DRR-IMP-dff87f5e-4
0.483
MAK-UNK-d4768348-7
0.476
MAK-UNK-c74072e5-9
0.474
MAR-TRE-6a44bbf2-52
0.468
LON-WEI-8f408cad-3
0.468
AAR-POS-0daf6b7e-15
0.468
AAR-POS-d2a4d1df-22
0.468
DRR-IMP-db50bf6e-5
0.468
MAK-UNK-d4768348-4
0.468
SAD-SAT-3a925b8b-9
0.468
BEN-DND-03406596-8
0.463
MAK-UNK-7c9d1431-12
0.460
AAR-POS-d2a4d1df-32
0.460
NIM-UNI-05f93fcc-1
0.460
MAK-UNK-d4768348-5
0.460
MAK-UNK-d4768348-8
0.460
MAR-TRE-6a44bbf2-4
0.460
SAD-SAT-3a925b8b-3
0.460
LON-WEI-8f408cad-2
0.460
MAR-TRE-6a44bbf2-24
0.453
DAN-MCD-50ec7d1f-1
0.453
ASH-SAT-43770c7d-10
0.452
KAT-UNK-b2a0d5b1-1
0.448
AAR-POS-d2a4d1df-34
0.446
MAR-TRE-6a44bbf2-8
0.446
DRR-IMP-dff87f5e-5
0.446
NIM-UNI-05f93fcc-11
0.443
MAR-TRE-6a44bbf2-7
0.441
MAK-UNK-d4768348-9
0.441
AAR-POS-d2a4d1df-37
0.441
NIM-UNI-05f93fcc-7
0.438
SAD-SAT-f2e2579e-5
0.438
MAK-UNK-d4768348-2
0.438
SAD-SAT-3a925b8b-6
0.438
MAK-UNK-d4768348-3
0.431
SAD-SAT-9a6c5cf3-6
0.425