yohimbine

Ligand Id: 102
Ligand name yohimbine

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 65.56
Molecular weight 354.19
XLogP 2.86
No. Lipinski's rules broken 0

Molecular properties generated using the CDK


Classification
Compound class Natural product or derivative
Approved drug? Yes (source: FDA (no date available))
DrugBank groups approved
IUPAC Name
methyl (1S,15R,18S,19R,20S)-18-hydroxy-3,13-diazapentacyclo[11.8.0.0^{2,10}.0^{4,9}.0^{15,20}]henicosa-2(10),4,6,8-tetraene-19-carboxylate
Synonyms
corynine
quebrachin
quebrachine
yohimbin
Database Links
CAS Registry No. 146-48-5 (source: Scifinder)
ChEBI CHEBI:10093
ChEMBL Ligand CHEMBL15245
DrugBank Ligand DB01392
PharmGKB Drug PA451946
PubChem CID 8969
Search Google for chemical match using the InChIKey BLGXFZZNTVWLAY-SCYLSFHTSA-N
Search Google for chemicals with the same backbone BLGXFZZNTVWLAY
Wikipedia Yohimbine
ZINC ZINC00608133