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Ligand

NameCHEMBL2375994
Molecular formulaC18H27NO5
IUPAC name8-[3-(tert-butylamino)-2-hydroxypropoxy]-7-methoxy-3-methyl-1H-isochromen-4-one
Molecular weight337.416
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP1.4
SynonymsN/A
Inchi KeyGAHLUZGNAVVXLH-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H27NO5/c1-11-16(21)13-6-7-15(22-5)17(14(13)10-23-11)24-9-12(20)8-19-18(2,3)4/h6-7,11-12,19-20H,8-10H2,1-5H3
PubChem CID53339617
ChEMBLCHEMBL2375994
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
91628Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466

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