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Ligand

NameCHEMBL2375990
Molecular formulaC16H23NO5
IUPAC name8-[3-(ethylamino)-2-hydroxypropoxy]-7-methoxy-3-methyl-1H-isochromen-4-one
Molecular weight309.362
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP0.8
SynonymsN/A
Inchi KeyAXCQOUZAVGWSTI-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H23NO5/c1-4-17-7-11(18)8-22-16-13-9-21-10(2)15(19)12(13)5-6-14(16)20-3/h5-6,10-11,17-18H,4,7-9H2,1-3H3
PubChem CID53339616
ChEMBLCHEMBL2375990
IUPHARN/A
BindingDBN/A
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
16559Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466

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