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Ligand

NameMLS000075167
Molecular formulaC13H16N4O3S
IUPAC nameN-cyclopentyl-2-[[5-(5-methyl-1,2-oxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
Molecular weight308.356
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP1.8
SynonymsASN 08214614
N-cyclopentyl-2-[[5-(5-methyl-1,2-oxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
CHEMBL1337081
N-cyclopentyl-2-[[5-(5-methylisoxazol-3-yl)-1,3,4-oxadiazol-2-yl]thio]acetamide
SR-01000346090-1
[ Show all ]
Inchi KeyDCIBYKPFOAKZRE-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H16N4O3S/c1-8-6-10(17-20-8)12-15-16-13(19-12)21-7-11(18)14-9-4-2-3-5-9/h6,9H,2-5,7H2,1H3,(H,14,18)
PubChem CID647358
ChEMBLCHEMBL1337081
IUPHARN/A
BindingDB41639
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
56369Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353

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