ML169

Ligand id: 5437

Name: ML169

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 102.58
Molecular weight 505.01
XLogP 5.37
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-{1-[(5-bromo-2-fluorophenyl)methyl]-1H-indole-3-sulfonyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Synonyms
ML-169 | VU0405652
Database Links
CAS Registry No. 1222878-02-5 (source: Scifinder)
ChEMBL Ligand CHEMBL1357815
PubChem CID 44475955
Search Google for chemical match using the InChIKey RUYRNYRGPSAXTK-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RUYRNYRGPSAXTK
Search UniChem for chemical match using the InChIKey RUYRNYRGPSAXTK-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone RUYRNYRGPSAXTK