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Ligand

NameMLS000068716
Molecular formulaC15H15N3O2S2
IUPAC name2-(6-methyl-2-phenacylsulfanylpyrimidin-4-yl)sulfanylacetamide
Molecular weight333.424
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.6
Synonyms2-(6-methyl-2-phenacylsulfanylpyrimidin-4-yl)sulfanylacetamide
BDBM32007
SMR000001750
2-[[6-methyl-2-(phenacylthio)pyrimidin-4-yl]thio]acetamide
cid_652313
[ Show all ]
Inchi KeyDAROBQBBWUPLNL-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H15N3O2S2/c1-10-7-14(21-9-13(16)20)18-15(17-10)22-8-12(19)11-5-3-2-4-6-11/h2-7H,8-9H2,1H3,(H2,16,20)
PubChem CID652313
ChEMBLCHEMBL1426787
IUPHARN/A
BindingDB32007
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
55278fMet-Leu-Phe receptorP21462FPR1Homo sapiens (Human)350
55277N-formyl peptide receptor 2P25090FPR2Homo sapiens (Human)351

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