compound 12 [PMID: 20299227]

Ligand id: 3134

Name: compound 12 [PMID: 20299227]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 9
Topological polar surface area 182.83
Molecular weight 392.05
XLogP 0.58
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
{5-[(4-phenyl-1,2,5-oxadiazol-3-yl)oxy]-1-phosphonopentyl}phosphonic acid
Database Links
ChEMBL Ligand CHEMBL1090779
PubChem CID 46885682
Search Google for chemical match using the InChIKey NPUHGRMCBDPTIW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NPUHGRMCBDPTIW
Search UniChem for chemical match using the InChIKey NPUHGRMCBDPTIW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone NPUHGRMCBDPTIW