compound 2 [PMID: 24793972]

Ligand id: 7798

Name: compound 2 [PMID: 24793972]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 11
Topological polar surface area 59.22
Molecular weight 455.29
XLogP 9.34
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(1R,2R)-N-[(2S,3S)-2-amino-3-methylpentyl]-N-[4-(4-propylphenyl)phenyl]-2-pyridin-2-ylcyclopropane-1-carboxamide
Database Links
GtoPdb PubChem SID 223366129
PubChem CID 58466521
Search Google for chemical match using the InChIKey OBGKRTYDTRUMGO-RFNYNIMXSA-N
Search Google for chemicals with the same backbone OBGKRTYDTRUMGO
Search UniChem for chemical match using the InChIKey OBGKRTYDTRUMGO-RFNYNIMXSA-N
Search UniChem for chemicals with the same backbone OBGKRTYDTRUMGO