diarylpropionitrile

Ligand id: 2825

Name: diarylpropionitrile

Abbreviated name: DPN

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 64.25
Molecular weight 239.09
XLogP 2.92
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2,3-bis(4-hydroxyphenyl)propanenitrile
Database Links
BindingDB Ligand 50106635
CAS Registry No. 1428-67-7 (source: Scifinder)
ChEMBL Ligand CHEMBL334773
NURSA Ligand 10.1621/PZBLDIG6Z7
PubChem CID 102614
Search Google for chemical match using the InChIKey GHZHWDWADLAOIQ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone GHZHWDWADLAOIQ
Comments
DPN is an estrogen receptor β selective agonist [3].