mavoglurant

Ligand id: 7586

Name: mavoglurant

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 49.77
Molecular weight 313.17
XLogP 4.74
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
methyl (3aR,4S,7aR)-4-hydroxy-4-[2-(3-methylphenyl)ethynyl]-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate
International Nonproprietary Names
INN number INN
9395 mavoglurant
Synonyms
AFQ-056
Database Links
CAS Registry No. 543906-09-8 (source: Scifinder)
ChEMBL Ligand CHEMBL3087515
PubChem CID 9926832
RCSB PDB Ligand 2U8&sid=4OO9
Search Google for chemical match using the InChIKey ZFPZEYHRWGMJCV-ZHALLVOQSA-N
Search Google for chemicals with the same backbone ZFPZEYHRWGMJCV
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Wikipedia Mavoglurant