 |
| Ligand Name: 1-(3-{5-[(3-chlorobenzyl)sulfonyl]-1H-tetrazol-1-yl}phenyl)ethanone |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB236 |
PubChem:
2992225
|
Synonym(s):
- zinc4727717
- stk743895
- akos002344022
- ccg-275415
- mcule-9200782068
- q27454833
- 728031-02-5
show 6 synonym(s)
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: CC(=O)c1cccc(c1)-n2c(nnn2)S(=O)(=O)Cc3cccc(Cl)c3 |
| Standard InChI: InChI=1S/C16H13ClN4O3S/c1-11(22)13-5-3-7-15(9-13)21-16(18-19-20-21)25(23,24)10-12-4-2-6-14(17)8-12/h2-9H,10H2,1H3 |
| Molecular Formula: C16H13ClN4O3S |
Mol. Weight: 376.0397 |
logP: 2.4922 |
| HBD: 0 | HBA: 7 |
| #Rotatable Bonds: 5 | TPSA: 94.81 |