compound (R)-4d [PMID: 16766089]

Ligand id: 5489

Name: compound (R)-4d [PMID: 16766089]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 12
Topological polar surface area 77.46
Molecular weight 505.25
XLogP 5.48
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[(2R)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}pyrrolidin-2-yl]acetic acid
Database Links
ChEMBL Ligand CHEMBL1164498
PubChem CID 9827510
Search Google for chemical match using the InChIKey LVXQSLPHTYSBIW-RUZDIDTESA-N
Search Google for chemicals with the same backbone LVXQSLPHTYSBIW
Search UniChem for chemical match using the InChIKey LVXQSLPHTYSBIW-RUZDIDTESA-N
Search UniChem for chemicals with the same backbone LVXQSLPHTYSBIW
Comments
The systematic name of this compound as used in the reference [1] is (R)-(1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}pyrrolidin-2-yl)acetic acid.