histamine

Ligand id: 1204

Name: histamine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 54.7
Molecular weight 111.08
XLogP -0.45
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
2-(3H-imidazol-4-yl)ethanamine
Database Links
CAS Registry No. 51-45-6
ChEBI CHEBI:18295
ChEMBL Ligand CHEMBL90
Human Metabolome Database HMDB00870
PubChem CID 774
RCSB PDB Ligand HSM
Search Google for chemical match using the InChIKey NTYJJOPFIAHURM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NTYJJOPFIAHURM
Wikipedia Histamine