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Ligand

NameCHEMBL359845
Molecular formulaC20H19N3O3
IUPAC nameN-butan-2-yl-1-(3-nitrophenyl)isoquinoline-3-carboxamide
Molecular weight349.39
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.5
SynonymsN/A
Inchi KeyQHXKGGWJWHBZJW-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19N3O3/c1-3-13(2)21-20(24)18-12-14-7-4-5-10-17(14)19(22-18)15-8-6-9-16(11-15)23(25)26/h4-13H,3H2,1-2H3,(H,21,24)
PubChem CID44390470
ChEMBLCHEMBL359845
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
278776Thyrotropin-releasing hormone receptorP21761TrhrMus musculus (Mouse)393

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