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Ligand

NameSR-01000759072-1
Molecular formulaC17H19N5OS
IUPAC name1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
Molecular weight341.433
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.0
Synonyms1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone
AC1M747Z
CHEMBL1328093
SCHEMBL17385566
BDBM41692
[ Show all ]
Inchi KeyAHPQZCDAMIJFNI-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H19N5OS/c1-12-9-15(16(23)11-24-17-18-19-20-21(17)3)13(2)22(12)10-14-7-5-4-6-8-14/h4-9H,10-11H2,1-3H3
PubChem CID2460650
ChEMBLCHEMBL1328093
IUPHARN/A
BindingDB41692
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
5795Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353

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