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Ligand

NameCHEMBL492375
Molecular formulaC25H26N4O3S
IUPAC name1-methylsulfonyl-N-(3-pyridin-4-ylphenyl)spiro[2H-indole-3,4'-piperidine]-1'-carboxamide
Molecular weight462.568
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.8
Synonyms1-(methylsulfonyl)-N-(3-(pyridin-4-yl)phenyl)spiro[indoline-3,4''-piperidine]-1''-carboxamide
BDBM50258051
1-(Methylsulfonyl)-N-[3-(pyridin-4-yl)phenyl]-1,2-dihydro-1''H-spiro[indole-3,4''-piperidine]-1''-carboxamide
Inchi KeyBBAUNXQABIGIPM-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H26N4O3S/c1-33(31,32)29-18-25(22-7-2-3-8-23(22)29)11-15-28(16-12-25)24(30)27-21-6-4-5-20(17-21)19-9-13-26-14-10-19/h2-10,13-14,17H,11-12,15-16,18H2,1H3,(H,27,30)
PubChem CID44573614
ChEMBLCHEMBL492375
IUPHARN/A
BindingDB50258051
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
19347Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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