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Ligand

NameCHEMBL2375985
Molecular formulaC17H25NO5
IUPAC name7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-6-methoxy-3-methyl-1H-isochromen-4-one
Molecular weight323.389
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP1.2
Synonyms7-[2-Hydroxy-3-(isopropylamino)propoxy]-6-methoxy-3-methylisochroman-4-one
Inchi KeyBKUMAHXJWHPFFA-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H25NO5/c1-10(2)18-7-13(19)9-23-16-5-12-8-22-11(3)17(20)14(12)6-15(16)21-4/h5-6,10-11,13,18-19H,7-9H2,1-4H3
PubChem CID71602836
ChEMBLCHEMBL2375985
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
26185Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466

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