compound 21 [PMID: 21185185]

Ligand id: 5789

Name: compound 21 [PMID: 21185185]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 7
Topological polar surface area 144.23
Molecular weight 389.15
XLogP 1.96
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(4R)-2-[[(2S)-2-amino-3-[3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-yl]propanoyl]amino]-4-methylcyclohexene-1-carboxylic acid
Database Links
ChEMBL Ligand CHEMBL1770358
PubChem CID 53238781
Search Google for chemical match using the InChIKey CDYGJIFOATYSNF-SKDRFNHKSA-N
Search Google for chemicals with the same backbone CDYGJIFOATYSNF
Search UniChem for chemical match using the InChIKey CDYGJIFOATYSNF-SKDRFNHKSA-N
Search UniChem for chemicals with the same backbone CDYGJIFOATYSNF