benzoquinazolinone 12

Ligand id: 8549

Name: benzoquinazolinone 12

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 71.25
Molecular weight 465.22
XLogP 4.64
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[(1S,2S)-2-hydroxycyclohexyl]-6-{[6-(1-methyl-1H-pyrazol-4-yl)pyridin-3-yl]methyl}-3H,4H-benzo[h]quinazolin-4-one
Database Links
PubChem CID 46196414
Search Google for chemical match using the InChIKey SXJQBWJPNSOKQV-UIOOFZCWSA-N
Search Google for chemicals with the same backbone SXJQBWJPNSOKQV
Search UniChem for chemical match using the InChIKey SXJQBWJPNSOKQV-UIOOFZCWSA-N
Search UniChem for chemicals with the same backbone SXJQBWJPNSOKQV