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Ligand

NameSCHEMBL3500473
Molecular formulaC33H25NO4S
IUPAC name2-[[5-(2-phenylethynyl)-1-benzothiophene-2-carbonyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid
Molecular weight531.626
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP7.6
SynonymsCHEMBL3718296
Inchi KeyUMXDGKPFCHXTCR-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H25NO4S/c35-32(31-21-27-19-24(15-18-30(27)39-31)12-11-23-7-3-1-4-8-23)34-29(33(36)37)20-25-13-16-28(17-14-25)38-22-26-9-5-2-6-10-26/h1-10,13-19,21,29H,20,22H2,(H,34,35)(H,36,37)
PubChem CID59335634
ChEMBLCHEMBL3718296
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
531064Probable G-protein coupled receptor 34Q9UPC5GPR34Homo sapiens (Human)381

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