JNJ-42153605

Ligand id: 6317

Name: JNJ-42153605

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 33.43
Molecular weight 400.19
XLogP 8.18
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-[3-(cyclopropylmethyl)-8-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-7-yl]-4-phenylpiperidine
Synonyms
JNJ 42153605
Database Links
CAS Registry No. 1254977-87-1 (source: Scifinder)
ChEMBL Ligand CHEMBL2179319
PubChem CID 49765871
Search Google for chemical match using the InChIKey BQAVZGJJQFJSMW-UHFFFAOYSA-N
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Search UniChem for chemical match using the InChIKey BQAVZGJJQFJSMW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BQAVZGJJQFJSMW