INOSITOL Next Previous

ChEMBL ID CHEMBL1222251
PubChem CID
DrugBank Accession Number DB13178
ClinicalTrials INOSITOL
Molecular Formula C6H12O6
Inchikey CDAISMWEOUEBRE-GPIVLXJGSA-N
Cas Number 6917-35-7

Smiles
O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O

Synonyms
CYCLOHEXANEHEXOL, INOSITOL, MESO-INOSITOL, NSC-25142, NSC-404118, NSC-55551, NSC-8101, Myo-inositol, Inositol

Libraries
O'Brien

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 1
Molecular Species NEUTRAL
Molecular Properties
Molecular Weight 180.16
Rotatable Bonds 0
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) -
LogD (ACD) -
ALogP -3.83
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