OCTOXYNOL 9 Next Previous

ChEMBL ID CHEMBL2104613
PubChem CID 75622
DrugBank Accession Number
ClinicalTrials OCTOXYNOL 9
Molecular Formula C28H50O8
Inchikey HNLXNOZHXNSSPN-UHFFFAOYSA-N

Smiles
CC(C)(C)CC(C)(C)c1ccc(OCCOCCOCCOCCOCCOCCOCCO)cc1

Synonyms
OCTOXINOL, OCTOXYNOL 9, TRITON X-100, Triton X

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts
Passes of Rule of 3
Rule of 5 Violations 1
Molecular Species NEUTRAL
Molecular Properties
Molecular Weight 514.69
Rotatable Bonds 24
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) 3.72
LogD (ACD) 3.72
ALogP 3.26
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