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Ligand

NameCHEMBL282424
Molecular formulaC18H19FN4
IUPAC name3-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine
Molecular weight310.376
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.8
Synonyms3-{[4-(2-fluorophenyl)-1-piperazinyl]methyl}-1H-pyrrolo[2,3-b]pyridine
SCHEMBL5196558
3-[4-(2-Fluoro-phenyl)-piperazin-1-ylmethyl]-1H-pyrrolo[2,3-b]pyridine
BDBM50099887
OOKNJSVAHXTYKL-UHFFFAOYSA-N
Inchi KeyOOKNJSVAHXTYKL-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H19FN4/c19-16-5-1-2-6-17(16)23-10-8-22(9-11-23)13-14-12-21-18-15(14)4-3-7-20-18/h1-7,12H,8-11,13H2,(H,20,21)
PubChem CID22065997
ChEMBLCHEMBL282424
IUPHARN/A
BindingDB50099887
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: 22
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
2463925-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
2463985-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
2463855-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
2464045-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
2463905-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
2464055-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
2463965-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
2463895-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
2464035-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
246402D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
246388D(1B) dopamine receptorP25115Drd5Rattus norvegicus (Rat)475
246400D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
246397D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446
246387D(4) dopamine receptorP30729Drd4Rattus norvegicus (Rat)387
246391Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
246395Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
246384Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
246399Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
246386Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
246401Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590

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