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Ligand

NameCHEMBL3907299
Molecular formulaC23H20FN3O4
IUPAC name4-[[cyclopropylmethyl-[5-(2-fluorophenoxy)pyrimidine-2-carbonyl]amino]methyl]benzoic acid
Molecular weight421.428
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.4
SynonymsBDBM251747
SCHEMBL16507194
US9464060, 83
Inchi KeyTXROCRKOYMGIGD-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H20FN3O4/c24-19-3-1-2-4-20(19)31-18-11-25-21(26-12-18)22(28)27(13-15-5-6-15)14-16-7-9-17(10-8-16)23(29)30/h1-4,7-12,15H,5-6,13-14H2,(H,29,30)
PubChem CID117903466
ChEMBLCHEMBL3907299
IUPHARN/A
BindingDB251747
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
544898Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
544897Lysophosphatidic acid receptor 5Q9H1C0LPAR5Homo sapiens (Human)372

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