 |
| Ligand Name: N-[(1S,2R,3R,4R,5R,6R)-3,4-dihydroxy-5-(hydroxymethyl)-7-oxabicyclo[4.1.0]heptan-2-yl]-2,2,2-trifluoroacetamide |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB895 |
PubChem:
- |
| Synonym(s):
-
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: OC[C@@H]([C@@H](O1)[C@@H]12)[C@@H](O)[C@H](O)[C@H]2NC(=O)C(F)(F)F |
| Standard InChI: InChI=1S/C9H12F3NO5/c10-9(11,12)8(17)13-3-5(16)4(15)2(1-14)6-7(3)18-6/h2-7,14-16H,1H2,(H,13,17)/t2-,3-,4-,5-,6-,7+/m1/s1 |
| Molecular Formula: C9H12F3NO5 |
Mol. Weight: 271.06674 |
logP: -1.8552 |
| HBD: 4 | HBA: 5 |
| #Rotatable Bonds: 2 | TPSA: 102.32 |