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ChEMBL ID CHEMBL170
PubChem CID 3034034
DrugBank Accession Number DB00468
ClinicalTrials QUININE
Molecular Formula C20H24N2O2
Inchikey LOUPRKONTZGTKE-WZBLMQSHSA-N
Cas Number 130-95-0

Smiles
C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@H](O)c1ccnc2ccc(OC)cc12

Synonyms
NSC-192949, Quinine, QUININE, WR297608

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 BASE
Molecular Properties
Molecular Weight 324.42
Rotatable Bonds 4
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) -
LogD (ACD) -
ALogP 3.17
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