compound 19 [PMID: 18800762]

Ligand id: 3193

Name: compound 19 [PMID: 18800762]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 5
Rotatable bonds 14
Topological polar surface area 164.14
Molecular weight 438.16
XLogP 2.93
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
{2-[3-(decyloxy)phenyl]-1-hydroxy-1-phosphonoethyl}phosphonic acid
Database Links
ChEMBL Ligand CHEMBL493443
GtoPdb PubChem SID 135649686
PubChem CID 25023868
Search Google for chemical match using the InChIKey MHLLAPRPDYGFFU-UHFFFAOYSA-N
Search Google for chemicals with the same backbone MHLLAPRPDYGFFU
Search UniChem for chemical match using the InChIKey MHLLAPRPDYGFFU-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone MHLLAPRPDYGFFU