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| Ligand Name: 2-BENZYL-3-IODO-PROPANOIC ACID |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB563 |
PubChem:
17753867
|
Synonym(s):
- 2-benzyl-3-iodopropanoic acid
- schembl21067694
- (2r)-2-benzyl-3-iodopropanoic acid
- db03441
- (r)-alpha-(iodomethyl)benzenepropanoic acid
- q27094365
show 5 synonym(s)
|
| DrugBank: DB03441 |
ChEMBL: CHEMBL1231355 |
| Canonical SMILES: OC(=O)[C@H](CI)Cc1ccccc1 |
| Standard InChI: InChI=1S/C10H11IO2/c11-7-9(10(12)13)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)/t9-/m0/s1 |
| Molecular Formula: C10H11IO2 |
Mol. Weight: 289.98038 |
logP: 2.3649 |
| HBD: 1 | HBA: 1 |
| #Rotatable Bonds: 4 | TPSA: 37.3 |