LY-518674

Ligand id: 2658

Name: LY-518674

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 9
Topological polar surface area 90.9
Molecular weight 410.21
XLogP 6.63
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-methyl-2-[4-[3-[1-[(4-methylphenyl)methyl]-5-oxo-2H-1,2,4-triazol-3-yl]propyl]phenoxy]propanoic acid
Synonyms
LY 518674 | LY518674
Database Links
BindingDB Ligand 50135780
CAS Registry No. 425671-29-0 (source: Scifinder)
ChEMBL Ligand CHEMBL424133
PubChem CID 9909438
Search Google for chemical match using the InChIKey PNHFDVSKDSLUFH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PNHFDVSKDSLUFH
Search UniChem for chemical match using the InChIKey PNHFDVSKDSLUFH-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PNHFDVSKDSLUFH