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Ligand

NameCHEMBL429681
Molecular formulaC21H27N5O2S2
IUPAC name7-methyl-N-[(2S)-1-[4-(2-methylphenyl)sulfonylpiperazin-1-yl]propan-2-yl]thieno[3,2-d]pyrimidin-4-amine
Molecular weight445.6
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP3.4
SynonymsBDBM50373829
Inchi KeyQHZZKPZSTGOWRD-KRWDZBQOSA-N
Inchi IDInChI=1S/C21H27N5O2S2/c1-15-6-4-5-7-18(15)30(27,28)26-10-8-25(9-11-26)12-17(3)24-21-20-19(22-14-23-21)16(2)13-29-20/h4-7,13-14,17H,8-12H2,1-3H3,(H,22,23,24)/t17-/m0/s1
PubChem CID44454165
ChEMBLCHEMBL429681
IUPHARN/A
BindingDB50373829
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
278838Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351

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