 |
| Ligand Name: (E)-4-fluorophenyl 3-(4-hydroxy-3,5-dimethylstyryl)benzoate |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB472 |
PubChem:
44472863
|
Synonym(s):
- chembl1213031
- 4-fluorophenyl 3-[(e)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]benzoate
- schembl12464304
- bdbm50323722
- q27457162
- 4-fluorophenyl 3-(4-hydroxy-3,5-dimethylstyryl)benzoate
- (4-fluorophenyl) 3-[(e)-2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]benzoate
show 6 synonym(s)
|
| DrugBank: - |
ChEMBL: CHEMBL1213031 |
| Canonical SMILES: Oc1c(C)cc(cc1C)/C=C/c2cccc(c2)C(=O)Oc3ccc(F)cc3 |
| Standard InChI: InChI=1S/C23H19FO3/c1-15-12-18(13-16(2)22(15)25)7-6-17-4-3-5-19(14-17)23(26)27-21-10-8-20(24)9-11-21/h3-14,25H,1-2H3/b7-6+ |
| Molecular Formula: C23H19FO3 |
Mol. Weight: 362.13184 |
logP: 5.53774 |
| HBD: 1 | HBA: 3 |
| #Rotatable Bonds: 4 | TPSA: 46.53 |