PGN-9856   Click here for help

GtoPdb Ligand ID: 10110

Synonyms: PGN 9856 | PGN9856
Compound class: Synthetic organic
Comment: Potent, selective, and efficacious prostanoid EP2 receptor agonist.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 75.63
Molecular weight 383.1
XLogP 4.55
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OC(=O)COc1cccc(c1)NC(=O)c1cc(ccc1F)c1cccc(c1)F
Isomeric SMILES OC(=O)COc1cccc(c1)NC(=O)c1cc(ccc1F)c1cccc(c1)F
InChI InChI=1S/C21H15F2NO4/c22-15-4-1-3-13(9-15)14-7-8-19(23)18(10-14)21(27)24-16-5-2-6-17(11-16)28-12-20(25)26/h1-11H,12H2,(H,24,27)(H,25,26)
InChI Key HZJWJNHYKNSGAT-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
2-[3-[[2-fluoro-5-(3-fluorophenyl)benzoyl]amino]phenoxy]acetic acid
Synonyms Click here for help
PGN 9856 | PGN9856
Database Links Click here for help
GtoPdb PubChem SID 381118820
PubChem CID 59654860
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