compound 4 [PMID: 19954973]

Ligand id: 8623

Name: compound 4 [PMID: 19954973]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 90.37
Molecular weight 275.13
XLogP 1.62
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S)-2-(2-aminoethoxy)-3-(1-phenylimidazol-4-yl)propanoic acid
Comments
Compound 4 is reported to inhibit the activatable fibrinolysis inhibitor, plasma carboxypeptidase B2 (CPB2) [1]. Inhibitors of CBP2 have been investigated as novel treatments for thrombosis.
Database Links
ChEMBL Ligand CHEMBL589645
GtoPdb PubChem SID 252166824
PubChem CID 10286113
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