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Ligand

NameCHEMBL88820
Molecular formulaC23H30N4O3
IUPAC name2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propanoylamino]-N,N-dimethylbenzamide
Molecular weight410.518
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.6
SynonymsBDBM50408208
Inchi KeyIUHSDXDFPGLZMT-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H30N4O3/c1-25(2)23(29)18-8-4-5-9-19(18)24-22(28)12-13-26-14-16-27(17-15-26)20-10-6-7-11-21(20)30-3/h4-11H,12-17H2,1-3H3,(H,24,28)
PubChem CID10716502
ChEMBLCHEMBL88820
IUPHARN/A
BindingDB50408208
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
142028Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
142027Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561

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