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Ligand

NameCHEMBL28997
Molecular formulaC18H19FN4
IUPAC name3-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-1H-pyrrolo[2,3-b]pyridine
Molecular weight310.376
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.8
Synonyms158984-93-1
SCHEMBL5198745
CTK0E6997
DTXSID80437653
BDBM50099893
[ Show all ]
Inchi KeyHNCAIEASLRMRKM-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H19FN4/c19-15-3-5-16(6-4-15)23-10-8-22(9-11-23)13-14-12-21-18-17(14)2-1-7-20-18/h1-7,12H,8-11,13H2,(H,20,21)
PubChem CID10267394
ChEMBLCHEMBL28997
IUPHARN/A
BindingDB50099893
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
1192135-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1192305-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
1192325-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
1192265-hydroxytryptamine receptor 1EP28566HTR1EHomo sapiens (Human)365
1192155-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
1192295-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
1192125-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
1192215-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
1192315-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
119223D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
119217D(1B) dopamine receptorP25115Drd5Rattus norvegicus (Rat)475
119227D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
119219D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446
119214D(4) dopamine receptorP30729Drd4Rattus norvegicus (Rat)387
119228Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
119218Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
119222Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
119225Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
119211Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
119216Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590

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