AFLATOXIN Next Previous

ChEMBL ID CHEMBL1697694
PubChem CID 186907
DrugBank Accession Number
ClinicalTrials AFLATOXIN
Molecular Formula C17H12O6
Inchikey OQIQSTLJSLGHID-WNWIJWBNSA-N
Cas Number 1402-68-2

Smiles
COc1cc2c(c3oc(=O)c4c(c13)CCC4=O)[C@@H]1C=CO[C@@H]1O2

Synonyms
Aflatoxin B1, Aflatoxin B1, Aflatoxin B2, Aflatoxin G1

Libraries
O'Brien

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 0
Molecular Species NEUTRAL
Molecular Properties
Molecular Weight 312.28
Rotatable Bonds 1
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) -
LogD (ACD) -
ALogP 2.28
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