Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(S(=O)(=O)c2ccccc2)CC1 |
MW: | 302.05 |
Fraction sp3: | 0.42 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 0.76 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine BB: | EN300-08172 |
Enamine SCR: | Z56943591 |
Enamine REAL: | Z56943591 |
Mcule: | MCULE-7671687983 |
MolPort: | MolPort-002-465-804 |
Activity Data | |
IC50 (µM) - Fluorescence: | 1.55667685318596 |
Order Status | |
Shipped: | 2021-06-02 |
Hetero_hetero
MAR-TRE-6a44bbf2-21
1.000
DRR-IMP-dff87f5e-3
0.667
AAR-POS-d2a4d1df-44
0.667
DRR-IMP-dff87f5e-7
0.654
PEI-IMP-ca0b2813-2
0.654
DRR-IMP-dff87f5e-1
0.654
MAR-TRE-6a44bbf2-58
0.654
MAR-LAB-efb042c5-5
0.654
AAR-POS-d2a4d1df-27
0.654
KAY-MCD-d0fe5261-1
0.654
MAR-TRE-6a44bbf2-68
0.654
MAK-UNK-7c9d1431-13
0.642
MAR-TRE-6a44bbf2-78
0.642
BEN-DND-03406596-10
0.630
MAR-TRE-6a44bbf2-18
0.630
LON-WEI-8f408cad-4
0.630
AAR-POS-d2a4d1df-23
0.630
SAD-SAT-3a925b8b-2
0.623
DRR-IMP-dff87f5e-6
0.618
DRR-IMP-dff87f5e-9
0.618
MAK-UNK-7c9d1431-17
0.618
MAK-UNK-c74072e5-8
0.618
PEI-IMP-ca0b2813-1
0.618
MAK-UNK-7c9d1431-6
0.618
DRR-IMP-dff87f5e-8
0.607
PEI-IMP-3d837503-2
0.596
MAT-POS-ee51dedd-2
0.593
MAK-UNK-7c9d1431-22
0.586
PEI-IMP-3d837503-4
0.585
DRR-IMP-dff87f5e-2
0.583
MAK-UNK-7c9d1431-3
0.583
JAY-UNK-11f5bdbd-1
0.582
TAT-ENA-80bfd3e5-43
0.576
MAR-TRE-6a44bbf2-65
0.576
MAK-UNK-7c9d1431-11
0.576
SAD-SAT-bc31ec01-5
0.574
BAP-BUY-55f8bcae-1
0.567
MAR-TRE-6a44bbf2-26
0.561
MAK-UNK-7c9d1431-8
0.561
MAK-UNK-7c9d1431-4
0.557
PEI-IMP-ca0b2813-3
0.557
TAT-ENA-80bfd3e5-25
0.557
IND-SYN-6c8299e8-2
0.557
DRR-IMP-dff87f5e-4
0.556
MAK-UNK-7c9d1431-12
0.554
MAK-UNK-7c9d1431-10
0.552
MAR-TRE-6a44bbf2-32
0.552
ABB-MCD-f8003a30-1
0.552
BEN-DND-03406596-8
0.550
AAR-POS-d2a4d1df-22
0.536
MAR-TRE-6a44bbf2-52
0.536
MAK-UNK-d4768348-4
0.536
LON-WEI-8f408cad-3
0.536
MAR-TRE-6a44bbf2-8
0.534
DRR-IMP-dff87f5e-5
0.534
AAR-POS-d2a4d1df-34
0.534
BEN-DND-03406596-3
0.532
BEN-DND-76ad4ac9-14
0.532
MAR-TRE-6a44bbf2-28
0.526
SAD-SAT-3a925b8b-3
0.526
AAR-POS-d2a4d1df-32
0.526
MAK-UNK-7c9d1431-23
0.526
LON-WEI-8f408cad-2
0.526
MAR-TRE-6a44bbf2-4
0.526
SAD-SAT-bc31ec01-4
0.525
MAK-UNK-7c9d1431-19
0.525
NIM-UNI-05f93fcc-2
0.516
SAD-SAT-3a925b8b-9
0.509
MAK-UNK-d4768348-1
0.509
AAR-POS-0daf6b7e-15
0.509
MAK-UNK-7c9d1431-27
0.508
MED-COV-4280ac29-5
0.507
MAK-UNK-d4768348-5
0.500
MAK-UNK-7c9d1431-7
0.500
MAK-UNK-7c9d1431-5
0.500
NIM-UNI-05f93fcc-1
0.500
MAK-UNK-d4768348-8
0.500
MAR-TRE-6a44bbf2-49
0.500
AAR-POS-d2a4d1df-37
0.500
MAR-TRE-6a44bbf2-7
0.500
MAR-TRE-6a44bbf2-31
0.500
MAK-UNK-7c9d1431-1
0.492
MAR-TRE-6a44bbf2-38
0.492
DRR-IMP-db50bf6e-4
0.492
MAK-UNK-d4768348-7
0.492
PEI-IMP-3d837503-3
0.491
BEN-DND-76ad4ac9-11
0.484
BEN-DND-03406596-9
0.484
DRR-IMP-db50bf6e-5
0.483
GIA-UNK-5ec6c2b8-4
0.481
MAR-TRE-6a44bbf2-36
0.478
MAK-UNK-7c9d1431-2
0.478
MAK-UNK-d4768348-2
0.475
SAD-SAT-3a925b8b-6
0.475
SAD-SAT-f2e2579e-5
0.471
BEN-DND-76ad4ac9-12
0.469
BEN-DND-03406596-5
0.469
BEN-DND-76ad4ac9-13
0.469
BEN-DND-03406596-2
0.469
SWA-SYN-6423ea73-2
0.468