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Ligand

NameSCHEMBL2841361
Molecular formulaC22H17N3O2S
IUPAC name(E)-3-[2-(4-methyl-3,5-diphenylpyrazol-1-yl)-1,3-thiazol-4-yl]prop-2-enoic acid
Molecular weight387.457
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.9
SynonymsCHEMBL3092148
SCHEMBL2841365
Inchi KeyAADUQEJYBCZCAP-OUKQBFOZSA-N
Inchi IDInChI=1S/C22H17N3O2S/c1-15-20(16-8-4-2-5-9-16)24-25(21(15)17-10-6-3-7-11-17)22-23-18(14-28-22)12-13-19(26)27/h2-14H,1H3,(H,26,27)/b13-12+
PubChem CID59179264
ChEMBLCHEMBL3092148
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
121Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402

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