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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL405292
Molecular formulaC17H18FN5
IUPAC name2-[[4-(6-fluoropyridin-2-yl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyridine
Molecular weight311.364
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP2.2
SynonymsBDBM50373498
Inchi KeyCECDNRUCUZFOLS-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H18FN5/c18-16-5-3-6-17(19-16)22-10-8-21(9-11-22)13-14-12-15-4-1-2-7-23(15)20-14/h1-7,12H,8-11,13H2
PubChem CID24824060
ChEMBLCHEMBL405292
IUPHARN/A
BindingDB50373498
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: 4
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GLASS IDNameUniProtGeneSpeciesLength
397695-hydroxytryptamine receptor 2AP50129HTR2ASus scrofa (Pig)470
39771D(1A) dopamine receptorP50130DRD1Sus scrofa (Pig)446
39768D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
39770D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400

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