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Ligand

NameCHEMBL91876
Molecular formulaC24H33N5O2
IUPAC name[2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]pyridin-3-yl]-pyrrolidin-1-ylmethanone
Molecular weight423.561
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.6
SynonymsBDBM50408242
Inchi KeyFGFCRXFPISRLAX-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H33N5O2/c1-31-22-10-3-2-9-21(22)28-18-16-27(17-19-28)13-7-12-26-23-20(8-6-11-25-23)24(30)29-14-4-5-15-29/h2-3,6,8-11H,4-5,7,12-19H2,1H3,(H,25,26)
PubChem CID10550225
ChEMBLCHEMBL91876
IUPHARN/A
BindingDB50408242
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
77709Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
77710Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561

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