compound 3a [PMID: 16099654]

Ligand id: 6205

Name: compound 3a [PMID: 16099654]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 77.25
Molecular weight 307.1
XLogP 4.14
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(5-methyl-1,2,4-oxadiazol-3-yl)-9H-xanthene-9-carboxamide
Database Links
ChEMBL Ligand CHEMBL492378
PubChem CID 44573698
Search Google for chemical match using the InChIKey KXBNLKGEYKHKAO-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KXBNLKGEYKHKAO
Search UniChem for chemical match using the InChIKey KXBNLKGEYKHKAO-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KXBNLKGEYKHKAO