BMS-986123

Ligand id: 9159

Name: BMS-986123

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 103.76
Molecular weight 395.07
XLogP 2.54
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[hydroxy({2-methoxy-5-[3-(4-methylbenzenesulfonyl)-1,3-thiazolidin-2-yl]phenyl})imino]-λ1-oxidanyl
Database Links
GtoPdb PubChem SID 315661242
PubChem CID 121231404
Search Google for chemical match using the InChIKey AXAIHSGKCYUSAN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AXAIHSGKCYUSAN
Search UniChem for chemical match using the InChIKey AXAIHSGKCYUSAN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AXAIHSGKCYUSAN
Comments
BMS-986123 is a silent (or neutral) allosteric modulator (SAM) of the μ opioid receptor [2]. It is one of the compounds claimed in patent WO2014107344 [1].