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Ligand

NameMLS000094258
Molecular formulaC15H10N4O2
IUPAC name2,6-dioxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
Molecular weight278.271
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP0.5
Synonyms2,6-dioxo-7-(prop-2-en-1-yl)-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
CHEMBL1300662
SR-01000100559-1
1-allyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
AC1MMI7W
[ Show all ]
Inchi KeyARCGSTOFFXSCJR-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H10N4O2/c1-2-6-19-13-11(8-10(9-16)14(19)20)15(21)18-7-4-3-5-12(18)17-13/h2-5,7-8H,1,6H2
PubChem CID3239161
ChEMBLCHEMBL1300662
IUPHARN/A
BindingDB30862
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
122965-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
12298Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
12299Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353
12295Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378
12297Sphingosine 1-phosphate receptor 4O95977S1PR4Homo sapiens (Human)384

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