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Ligand

NameBDBM31035
Molecular formulaC23H25N3O6
IUPAC nameethyl 6-[4-(2-anilino-2-oxoethoxy)-3-methoxyphenyl]-4-methyl-2-oxo-5,6-dihydro-1H-pyrimidine-5-carboxylate
Molecular weight439.468
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.3
Synonyms4-[4-(2-anilino-2-keto-ethoxy)-3-methoxy-phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
cid_3154442
4-[4-(2-anilino-2-oxoethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
ethyl 4-[3-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Inchi KeyFUDKKBFANBSPIG-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H25N3O6/c1-4-31-22(28)20-14(2)24-23(29)26-21(20)15-10-11-17(18(12-15)30-3)32-13-19(27)25-16-8-6-5-7-9-16/h5-12,20-21H,4,13H2,1-3H3,(H,25,27)(H,26,29)
PubChem CID91896121
ChEMBLN/A
IUPHARN/A
BindingDB31035
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
873605-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
873585-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
87359Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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