VPC12249

Ligand id: 2909

Name: VPC12249

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 25
Topological polar surface area 114.9
Molecular weight 601.35
XLogP 11.18
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[(2R)-2-[[(Z)-octadec-9-enoyl]amino]-3-[4-(phenylmethoxy)phenyl]propyl] dihydrogen phosphate
Synonyms
VPC 12249 | VPC-12249
Database Links
BindingDB Ligand 50146254
CAS Registry No. 403520-23-0 (source: Scifinder)
ChEMBL Ligand CHEMBL327240
PubChem CID 10282223
Search Google for chemical match using the InChIKey NJLPYJKKKSBCSK-MJPIYRIWSA-N
Search Google for chemicals with the same backbone NJLPYJKKKSBCSK
Search UniChem for chemical match using the InChIKey NJLPYJKKKSBCSK-MJPIYRIWSA-N
Search UniChem for chemicals with the same backbone NJLPYJKKKSBCSK