IONOMYCIN Next Previous

ChEMBL ID CHEMBL501617
PubChem CID 6912226
DrugBank Accession Number
ClinicalTrials IONOMYCIN
Molecular Formula C41H72O9
Inchikey PGHMRUGBZOYCAA-ADZNBVRBSA-N
Cas Number 56092-81-0

Smiles
C[C@H](C[C@H](C)C(=O)/C=C(\O)[C@H](C)C[C@H](C)C/C=C/[C@@H](C)[C@@H](O)[C@@H](C)[C@@H](O)C[C@@H]1CC[C@@](C)([C@H]2CC[C@@](C)([C@@H](C)O)O2)O1)C[C@H](C)CCC(=O)O

Synonyms
Ionomycin

Libraries
O'Brien

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 2
Molecular Species ACID
Molecular Properties
Molecular Weight 709.02
Rotatable Bonds 22
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) -
LogD (ACD) -
ALogP 7.8
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