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Ligand

NameEnamine_005764
Molecular formulaC23H21N3O2S
IUPAC nameN-benzyl-N-(2-hydroxyethyl)-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide
Molecular weight403.5
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.5
SynonymsMolPort-003-998-460
HMS1410F22
SMR000155032
AC1M5U1T
MCULE-8270384234
[ Show all ]
Inchi KeyAGFZURJKVLBPDF-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H21N3O2S/c27-14-13-25(16-18-8-3-1-4-9-18)23(28)20-17-26(19-10-5-2-6-11-19)24-22(20)21-12-7-15-29-21/h1-12,15,17,27H,13-14,16H2
PubChem CID2336056
ChEMBLCHEMBL1432530
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4846Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
4847Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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