Ligand Id: 4687
Ligand name [3H]estradiol-17β-glucuronide

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 5
Rotatable bonds 3
Topological polar surface area 136.68
Molecular weight 448.21
XLogP 3.7
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Metabolite or derivative
IUPAC Name
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-{[(1S,10R,11S,14S,15S)-5-hydroxy-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2(7),3,5-trien-14-yl]oxy}oxane-2-carboxylic acid
Synonyms
[3H]-estradiol-17β-glucuronide
Database Links
Search on ChemSpider MTKNDAQYHASLID-QXYWQCSFSA-N
ZINC ZINC04099035

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org