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Ligand

NameCHEMBL343466
Molecular formulaC20H22N4
IUPAC name1-[(1-phenylpyrrol-3-yl)methyl]-4-pyridin-2-ylpiperazine
Molecular weight318.424
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.0
Synonyms4-(Pyridin-2-yl)-1-[(1-phenyl-1H-pyrrol-3-yl)methyl]piperazine
1-(1-Phenyl-1H-pyrrol-3-ylmethyl)-4-pyridin-2-yl-piperazine
BDBM50048230
ZINC13744965
Inchi KeyGPHWCCPBYXWRBX-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H22N4/c1-2-6-19(7-3-1)24-11-9-18(17-24)16-22-12-14-23(15-13-22)20-8-4-5-10-21-20/h1-11,17H,12-16H2
PubChem CID10336039
ChEMBLCHEMBL343466
IUPHARN/A
BindingDB50048230
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: 3
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GLASS IDNameUniProtGeneSpeciesLength
101969D(2) dopamine receptorP52702DRD2Chlorocebus aethiops (Green monkey)443
101968D(3) dopamine receptorP52703DRD3Chlorocebus aethiops (Green monkey)400
101970D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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