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Ligand

NameCHEMBL3982536
Molecular formulaC21H24FN5O7S
IUPAC nameethyl (1R,5R)-3-[6-(2-fluoro-4-methylsulfonylanilino)-5-nitropyrimidin-4-yl]oxy-8-azabicyclo[3.2.1]octane-8-carboxylate
Molecular weight509.509
Hydrogen bond acceptor11
Hydrogen bond donor1
XlogP3.5
SynonymsBDBM50204229
Inchi KeyBMXINKWPXAYFRZ-CHWSQXEVSA-N
Inchi IDInChI=1S/C21H24FN5O7S/c1-3-33-21(28)26-12-4-5-13(26)9-14(8-12)34-20-18(27(29)30)19(23-11-24-20)25-17-7-6-15(10-16(17)22)35(2,31)32/h6-7,10-14H,3-5,8-9H2,1-2H3,(H,23,24,25)/t12-,13-/m1/s1
PubChem CID134156958
ChEMBLCHEMBL3982536
IUPHARN/A
BindingDB50204229
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
548192Glucose-dependent insulinotropic receptorQ8TDV5GPR119Homo sapiens (Human)335

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