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Ligand

NameCHEMBL193620
Molecular formulaC21H26F3N3O2
IUPAC name8-[2-[4-(2,4,5-trifluorophenyl)piperazin-1-yl]ethyl]-8-azaspiro[4.5]decane-7,9-dione
Molecular weight409.453
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP3.1
SynonymsAUQZROKGNYIFMG-UHFFFAOYSA-N
8-{2-[4-(2,4,5-Trifluoro-phenyl)-piperazin-1-yl]-ethyl}-8-aza-spiro[4.5]decane-7,9-dione
BDBM50165417
SCHEMBL6752779
8-{2-[4-(2,4,5-trifluorophenyl)piperazin-1-yl]ethyl}-8-azaspiro[4.5]decane-7,9-dione
Inchi KeyAUQZROKGNYIFMG-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H26F3N3O2/c22-15-11-17(24)18(12-16(15)23)26-8-5-25(6-9-26)7-10-27-19(28)13-21(14-20(27)29)3-1-2-4-21/h11-12H,1-10,13-14H2
PubChem CID9931327
ChEMBLCHEMBL193620
IUPHARN/A
BindingDB50165417
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
149025-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
14906Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
14904Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
14901Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
14903D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
14905D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446

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