CPP-115

Ligand id: 8284

Name: CPP-115

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 63.32
Molecular weight 177.06
XLogP -0.44
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(1S,3S)-3-amino-4-(difluoromethylidene)cyclopentane-1-carboxylic acid
Synonyms
compound 12 [PMID 25616005] [2]
Database Links
CAS Registry No. 640897-20-7
ChEMBL Ligand CHEMBL146927
PubChem CID 9794014
Search Google for chemical match using the InChIKey CBSRETZPFOBWNG-UCORVYFPSA-N
Search Google for chemicals with the same backbone CBSRETZPFOBWNG
Search UniChem for chemical match using the InChIKey CBSRETZPFOBWNG-UCORVYFPSA-N
Search UniChem for chemicals with the same backbone CBSRETZPFOBWNG
Comments
CPP-115 is a vigabatrin analogue with improved tolerability compared to the parent compound [1].