3-ISOPROPYLPHENOL Next Previous

ChEMBL ID CHEMBL449684
PubChem CID 12059
DrugBank Accession Number
ClinicalTrials 3-ISOPROPYLPHENOL
Molecular Formula C9H12O
Inchikey VLJSLTNSFSOYQR-UHFFFAOYSA-N
Cas Number 618-45-1

Smiles
CC(C)c1cccc(O)c1

Synonyms
3-Isopropylphenol

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 136.19
Rotatable Bonds 1
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) -
LogD (ACD) -
ALogP 2.52
Loading...