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Ligand

NameCHEMBL575812
Molecular formulaC13H17N5O3
IUPAC nameethyl 4-(4-methylpiperazin-1-yl)-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
Molecular weight291.311
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP1.1
SynonymsCCG-183072
ethyl 4-(4-methylpiperazin-1-yl)isoxazolo[5,4-d]pyrimidine-3-carboxylate
AKOS002009789
BDBM50298337
Inchi KeyAGGMAFMCVTYVQY-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H17N5O3/c1-3-20-13(19)10-9-11(14-8-15-12(9)21-16-10)18-6-4-17(2)5-7-18/h8H,3-7H2,1-2H3
PubChem CID45482399
ChEMBLCHEMBL575812
IUPHARN/A
BindingDB50298337
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
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GLASS IDNameUniProtGeneSpeciesLength
48535-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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