Ligand Id: 4158
Ligand name chlorobenzylidene malononitrile

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 47.58
Molecular weight 188.01
XLogP 2.69
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Synthetic organic
IUPAC Name
2-[(2-chlorophenyl)methylidene]propanedinitrile
Database Links
Search on ChemSpider JJNZXLAFIPKXIG-UHFFFAOYSA-N
ZINC ZINC00160747

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org