RO 116 1148

Ligand id: 252

Name: RO 116 1148

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 50.8
Molecular weight 332.21
XLogP 2.67
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[(1-butylpiperidin-4-yl)methyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide
Synonyms
RO 116-1148
Database Links
ChEMBL Ligand CHEMBL182590
PubChem CID 44391713
Search Google for chemical match using the InChIKey VBFBEYXWJLASJA-UHFFFAOYSA-N
Search Google for chemicals with the same backbone VBFBEYXWJLASJA
Search UniChem for chemical match using the InChIKey VBFBEYXWJLASJA-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone VBFBEYXWJLASJA