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Ligand

Name4'-Isobutyrylhomoeriodictyol
Molecular formulaC20H20O7
IUPAC name[4-[(2S)-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl]-2-methoxyphenyl] 2-methylpropanoate
Molecular weight372.373
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.5
SynonymsCHEMBL490162
BDBM50384791
Inchi KeyIGCZWOGVHOOOEO-INIZCTEOSA-N
Inchi IDInChI=1S/C20H20O7/c1-10(2)20(24)27-15-5-4-11(6-17(15)25-3)16-9-14(23)19-13(22)7-12(21)8-18(19)26-16/h4-8,10,16,21-22H,9H2,1-3H3/t16-/m0/s1
PubChem CID44576022
ChEMBLCHEMBL490162
IUPHARN/A
BindingDB50384791
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
132428Taste receptor type 2 member 31P59538TAS2R31Homo sapiens (Human)309

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