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Ligand

NameCHEMBL2205915
Molecular formulaC18H15N5O2S
IUPAC name13-(cyclopropylamino)-5-(4-methoxyphenyl)-8-thia-3,5,10,12-tetrazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
Molecular weight365.411
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.3
Synonyms13-(cyclopropylamino)-5-(4-methoxyphenyl)-8-thia-3,5,10,12-tetraazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,9,11-pentaen-6-one
GTPL6365
BDBM50401676
compound 10i [PMID: 23084894]
SCHEMBL8242394
[ Show all ]
Inchi KeyDBUMITZHDMTTNX-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H15N5O2S/c1-25-12-6-4-11(5-7-12)23-9-21-14-13-16(22-10-2-3-10)19-8-20-17(13)26-15(14)18(23)24/h4-10H,2-3H2,1H3,(H,19,20,22)
PubChem CID57559562
ChEMBLCHEMBL2205915
IUPHAR6365
BindingDB50401676
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
56018Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
56019Metabotropic glutamate receptor 1P23385Grm1Rattus norvegicus (Rat)1199
56017Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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