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Ligand

NameSMR000211820
Molecular formulaC23H21N5O2
IUPAC name2-methyl-4-[4-(5-nitroquinolin-8-yl)piperazin-1-yl]quinoline
Molecular weight399.454
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.4
SynonymsA2409/0102076
MCULE-1722260992
STK068794
1-(2-methyl(4-quinolyl))-4-(5-nitro(8-quinolyl))piperazine
BDBM83317
[ Show all ]
Inchi KeyBDDPXUZRHMQXHU-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H21N5O2/c1-16-15-22(17-5-2-3-7-19(17)25-16)27-13-11-26(12-14-27)21-9-8-20(28(29)30)18-6-4-10-24-23(18)21/h2-10,15H,11-14H2,1H3
PubChem CID2885420
ChEMBLCHEMBL1545927
IUPHARN/A
BindingDB83317
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
208265-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
20825Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
20827Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
20824Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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