NPS 2143

Ligand Id: 716
Ligand name NPS 2143

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 65.28
Molecular weight 408.16
XLogP 7.18
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
IUPAC Name
2-chloro-6-[(2R)-2-hydroxy-3-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]propoxy]benzonitrile
Synonyms
2-chloro-6-[2-hydroxy-3-[(2-methyl-1-naphthalen-2-ylpropan-2-yl)amino]propoxy]benzonitrile
2-chloro-6-[3-[[1,1-dimethyl-2-(2-naphthyl)ethyl]amino]-2-hydroxy​-propoxy]benzonitrile
N-[(R)-2-hydroxy-3-(2-cyano-3-chlorophenoxy)propyl]-1,1-dimethyl-2-(2-naphthyl)ethylamine
Database Links
CAS Registry No. 284035-33-2 (source: Scifinder)
ChEMBL Ligand 400499, 433957
PubChem CID 20812747
Search Google for chemical match using the InChIKey PZUJQWHTIRWCID-HXUWFJFHSA-N
Search Google for chemicals with the same backbone PZUJQWHTIRWCID
ZINC ZINC03975668, ZINC28564671