EMRICASAN Next Previous

ChEMBL ID CHEMBL197672
PubChem CID 12000240
DrugBank Accession Number DB05408
ClinicalTrials EMRICASAN
Molecular Formula C26H27F4N3O7
Inchikey SCVHJVCATBPIHN-SJCJKPOMSA-N

Smiles
C[C@H](NC(=O)C(=O)Nc1ccccc1C(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)COc2c(F)c(F)cc(F)c2F

Synonyms
EMRICASAN, IDN 6556, PF 03491390

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts
Passes of Rule of 3
Rule of 5 Violations 1
Molecular Species ACID
Molecular Properties
Molecular Weight 569.51
Rotatable Bonds 10
Acidic pKa (ACD) 3.91
Basic pKa (ACD) 1.01
LogP (ACD) 3.54
LogD (ACD) 0.17
ALogP 2.59
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