LITHOCHOLIC ACID Next Previous

ChEMBL ID CHEMBL1478
PubChem CID 9903
DrugBank Accession Number
ClinicalTrials LITHOCHOLIC ACID
Molecular Formula C24H40O3
Inchikey SMEROWZSTRWXGI-HVATVPOCSA-N
Cas Number 434-13-9

Smiles
C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C

Synonyms
Lithocholate, Lithocholic Acid, Litocholic Acid, Lithocholic acid

Libraries
ScreenWell

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 1
Molecular Species ACID
Molecular Properties
Molecular Weight 376.58
Rotatable Bonds 4
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) -
LogD (ACD) -
ALogP 5.51
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