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Ligand

NameCHEMBL2333757
Molecular formulaC20H16F3N3O2
IUPAC name1-benzyl-3-[2-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]urea
Molecular weight387.362
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50429551
Inchi KeyBRAQTBZPTCUHQV-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H16F3N3O2/c21-20(22,23)15-8-4-9-16(12-15)28-18-17(10-5-11-24-18)26-19(27)25-13-14-6-2-1-3-7-14/h1-12H,13H2,(H2,25,26,27)
PubChem CID71574662
ChEMBLCHEMBL2333757
IUPHARN/A
BindingDB50429551
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
30825P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373

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