compound 6 [Biller et al., 1991]

Ligand id: 3132

Name: compound 6 [Biller et al., 1991]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 12
Topological polar surface area 123.68
Molecular weight 394.17
XLogP 2.03
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
{[hydroxy({[(2E,6Z)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]oxy}methyl)phosphoryl]methyl}phosphonic acid
Database Links
ChEMBL Ligand CHEMBL1161372
PubChem CID 44370654
Search Google for chemical match using the InChIKey NQSFGDNIHNVCHW-KKYJLSSQSA-N
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Search UniChem for chemical match using the InChIKey NQSFGDNIHNVCHW-KKYJLSSQSA-N
Search UniChem for chemicals with the same backbone NQSFGDNIHNVCHW