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Ligand

NameCHEMBL331202
Molecular formulaC28H32ClN3O3
IUPAC name1-[2-[(4-chlorophenoxy)methyl]-1-methylindol-3-yl]-2-(4-piperidin-1-ylpiperidin-1-yl)ethane-1,2-dione
Molecular weight494.032
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.9
Synonyms1-methyl-2-(4-chlorophenoxymethyl)-3-[2-[4-(piperidin-1-yl)piperidin-1-yl]-1,2-ethanedionyl]-1H-indole
SCHEMBL7963164
1-[1,4'']Bipiperidinyl-1''-yl-2-[2-(4-chloro-phenoxymethyl)-1-methyl-1H-indol-3-yl]-ethane-1,2-dione
BDBM50060723
GMNSKOPBGHCMQS-UHFFFAOYSA-N
[ Show all ]
Inchi KeyGMNSKOPBGHCMQS-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H32ClN3O3/c1-30-24-8-4-3-7-23(24)26(25(30)19-35-22-11-9-20(29)10-12-22)27(33)28(34)32-17-13-21(14-18-32)31-15-5-2-6-16-31/h3-4,7-12,21H,2,5-6,13-19H2,1H3
PubChem CID10625004
ChEMBLCHEMBL331202
IUPHARN/A
BindingDB50060723
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
100060Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384
100061Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381
100062Neuropeptide Y receptor type 4P50391NPY4RHomo sapiens (Human)375
100059Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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