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Ligand

NameCHEMBL3686004
Molecular formulaC23H23BrFN3O3
IUPAC name2-[1-[[4-[(3-bromo-4-fluorophenyl)carbamoyl]phenyl]methyl]-3,5-diethylpyrazol-4-yl]acetic acid
Molecular weight488.357
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.6
SynonymsUS8791272, 9.14
BDBM127246
SCHEMBL10173852
Inchi KeyADNIITVBXUVHQD-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H23BrFN3O3/c1-3-20-17(12-22(29)30)21(4-2)28(27-20)13-14-5-7-15(8-6-14)23(31)26-16-9-10-19(25)18(24)11-16/h5-11H,3-4,12-13H2,1-2H3,(H,26,31)(H,29,30)
PubChem CID68052953
ChEMBLCHEMBL3686004
IUPHARN/A
BindingDB127246
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2427Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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