[3H]CGP 54626

Ligand id: 1090

Name: [3H]CGP 54626    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 79.37
Molecular weight 407.12
XLogP 3.93
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
cyclohexylmethyl-[(2S)-3-[[(1S)-1-(3,4-dichlorophenyl)ethyl]amino]-2-hydroxypropyl]phosphinic acid
Synonyms
[3H]CGP54626
Database Links
ChEMBL Ligand CHEMBL1213187
PubChem CID 197584
RCSB PDB Ligand 2BV
Search Google for chemical match using the InChIKey JGGVBBYJRQOPPA-BBRMVZONSA-N
Search Google for chemicals with the same backbone JGGVBBYJRQOPPA
Search UniChem for chemical match using the InChIKey JGGVBBYJRQOPPA-BBRMVZONSA-N
Search UniChem for chemicals with the same backbone JGGVBBYJRQOPPA