putrescine

Ligand id: 2388

Name: putrescine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 52.04
Molecular weight 88.1
XLogP -0.63
No. Lipinski's rules broken 0

Molecular properties generated using the CDK
Classification
Compound class Metabolite or derivative
IUPAC Name
but-2-ynedinitrile
Database Links
BindingDB Ligand 50009385
CAS Registry No. 110-60-1 (source: DrugBank)
ChEBI CHEBI:17148
ChEMBL Ligand CHEMBL46257
DrugBank Ligand DB01917
GtoPdb PubChem SID 135651553
PubChem CID 1045
RCSB PDB Ligand PUT
Search Google for chemical match using the InChIKey KIDHWZJUCRJVML-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KIDHWZJUCRJVML
Search UniChem for chemical match using the InChIKey KIDHWZJUCRJVML-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KIDHWZJUCRJVML
Wikipedia Putrescine