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Ligand

NameCHEMBL402793
Molecular formulaC23H18F3N5O3
IUPAC name1-[2-(5-methyl-2-pyridin-3-ylpyrazol-3-yl)oxyphenyl]-3-[4-(trifluoromethoxy)phenyl]urea
Molecular weight469.424
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP4.8
SynonymsBDBM50373295
Inchi KeyAPPZNEHVEDRDMB-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H18F3N5O3/c1-15-13-21(31(30-15)17-5-4-12-27-14-17)33-20-7-3-2-6-19(20)29-22(32)28-16-8-10-18(11-9-16)34-23(24,25)26/h2-14H,1H3,(H2,28,29,32)
PubChem CID44448868
ChEMBLCHEMBL402793
IUPHARN/A
BindingDB50373295
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
11228P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373

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