J-104123

Ligand id: 3110

Name: J-104123

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 11
Topological polar surface area 66.4
Molecular weight 497.15
XLogP 9.65
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3R)-4-{[(2S,3S,4E)-3-[(3,4-dichlorophenyl)methyl]-5-(naphthalen-2-yl)pent-4-en-2-yl]carbamoyl}-3-methylbutanoic acid
Database Links
ChEMBL Ligand CHEMBL143820
PubChem CID 9848748
Search Google for chemical match using the InChIKey LVRZMZFXRFKCCY-KSYFVSBMSA-N
Search Google for chemicals with the same backbone LVRZMZFXRFKCCY
Search UniChem for chemical match using the InChIKey LVRZMZFXRFKCCY-KSYFVSBMSA-N
Search UniChem for chemicals with the same backbone LVRZMZFXRFKCCY