RXP-407

Ligand id: 7894

Name: RXP-407

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 12
Hydrogen bond donors 6
Rotatable bonds 16
Topological polar surface area 214.8
Molecular weight 498.19
XLogP 0.1
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3S)-3-acetamido-4-[[(1R)-1-[[(2S)-3-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-2-methyl-3-oxopropyl]-hydroxyphosphoryl]-2-phenylethyl]amino]-4-oxobutanoic acid
Synonyms
RXP 407
Database Links
ChEMBL Ligand CHEMBL1235767
PubChem CID 9827219
RCSB PDB Ligand RX4
Search Google for chemical match using the InChIKey OCAZUTUOYLAIOA-OSRSDYAFSA-N
Search Google for chemicals with the same backbone OCAZUTUOYLAIOA
Search UniChem for chemical match using the InChIKey OCAZUTUOYLAIOA-OSRSDYAFSA-N
Search UniChem for chemicals with the same backbone OCAZUTUOYLAIOA
SynPHARM 80724 (in complex with Angiotensin-converting enzyme)
Comments
N-domain selective ACE inhibitor. This N-section corresponds to 30-630