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Ligand

NameCHEMBL1093561
Molecular formulaC16H14N6OS
IUPAC name13-amino-11-(methylamino)-5-(4-methylphenyl)-8-thia-3,5,10,12-tetrazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
Molecular weight338.389
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP2.7
SynonymsSCHEMBL8245921
BDBM50316006
9-Amino-7-methylamino-3-p-tolyl-3H-thieno[2,3-d:4,5-d'']dipyrimidin-4-one
Inchi KeyBJPPTGLQJGWMJU-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H14N6OS/c1-8-3-5-9(6-4-8)22-7-19-11-10-13(17)20-16(18-2)21-14(10)24-12(11)15(22)23/h3-7H,1-2H3,(H3,17,18,20,21)
PubChem CID46886169
ChEMBLCHEMBL1093561
IUPHARN/A
BindingDB50316006
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
25354Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
25353Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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