compound 19 [PMID: 18754614]

Ligand id: 3074

Name: compound 19 [PMID: 18754614]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 32.7
Molecular weight 387.08
XLogP 5.54
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[4-(4-bromophenyl)phenyl]-octahydropyrido[2,1-c]morpholin-3-ol
Database Links
ChEMBL Ligand CHEMBL494913
GtoPdb PubChem SID 135649722
PubChem CID 25108303
Search Google for chemical match using the InChIKey IFRLXVCJEQULMZ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone IFRLXVCJEQULMZ
Search UniChem for chemical match using the InChIKey IFRLXVCJEQULMZ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone IFRLXVCJEQULMZ