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Ligand

NameCHEMBL224322
Molecular formulaC21H24N4OS
IUPAC name5-(1-adamantyl)-13-(dimethylamino)-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
Molecular weight380.51
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.3
SynonymsBDBM50177068
9-dimethylamino-3-(1-adamantyl)-3H-5-thia-1,3,6-triazafluoren-4-one
3-Adamantan-1-yl-9-dimethylamino-3H-pyrido[3'',2'':4,5]thieno[3,2-d]pyrimidin-4-one
Inchi KeyAKQCXZGTHURUGU-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H24N4OS/c1-24(2)15-3-4-22-19-16(15)17-18(27-19)20(26)25(11-23-17)21-8-12-5-13(9-21)7-14(6-12)10-21/h3-4,11-14H,5-10H2,1-2H3
PubChem CID11696595
ChEMBLCHEMBL224322
IUPHARN/A
BindingDB50177068
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
7789Metabotropic glutamate receptor 1P23385Grm1Rattus norvegicus (Rat)1199
7790Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
7791Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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