[3H]N-methyl-SSR504734

Ligand id: 4603

Name: [3H]N-methyl-SSR504734    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 32.34
Molecular weight 410.14
XLogP 6.94
No. Lipinski's rules broken 1

Molecular properties generated using the CDK
Classification
Compound class Synthetic organic
IUPAC Name
2-chloro-N-[(S)-[(2S)-1-methylpiperidin-2-yl](phenyl)methyl]-3-(trifluoromethyl)benzamide
Synonyms
[3H]-N-methyl-SSR504734
Database Links
ChEMBL Ligand CHEMBL1939495
GtoPdb PubChem SID 178101323
PubChem CID 11704260
Search Google for chemical match using the InChIKey XPXKFXNVIAOBEI-HKUYNNGSSA-N
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Search UniChem for chemical match using the InChIKey XPXKFXNVIAOBEI-HKUYNNGSSA-N
Search UniChem for chemicals with the same backbone XPXKFXNVIAOBEI