JNJ-10397049

Ligand id: 1701

Name: JNJ-10397049

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 59.59
Molecular weight 481.98
XLogP 5.96
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-(2,4-dibromophenyl)-1-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]urea
Synonyms
compound 9 [PMID: 15261275] | JNJ 10397049 | JNJ10397049
Database Links
CAS Registry No. 708275-58-5 (source: Scifinder)
ChEMBL Ligand CHEMBL359632
PubChem CID 9869934
Search Google for chemical match using the InChIKey RBKIJGLHFFQHBE-IRXDYDNUSA-N
Search Google for chemicals with the same backbone RBKIJGLHFFQHBE
Search UniChem for chemical match using the InChIKey RBKIJGLHFFQHBE-IRXDYDNUSA-N
Search UniChem for chemicals with the same backbone RBKIJGLHFFQHBE
Comments
JNJ-10397049 is an OX2 receptor selective antagonist (2-SORA).