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Ligand

NameCHEMBL240866
Molecular formulaC22H22ClN3O3S
IUPAC nameN-[(4-chlorophenyl)methyl]-2-[(4-methylphenyl)sulfonyl-(2-methylpyridin-3-yl)amino]acetamide
Molecular weight443.946
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.8
SynonymsN/A
Inchi KeyBEYXVJNYFYLBFA-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H22ClN3O3S/c1-16-5-11-20(12-6-16)30(28,29)26(21-4-3-13-24-17(21)2)15-22(27)25-14-18-7-9-19(23)10-8-18/h3-13H,14-15H2,1-2H3,(H,25,27)
PubChem CID44439620
ChEMBLCHEMBL240866
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
22053Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402

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