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Ligand

NameCHEMBL1631541
Molecular formulaC26H31N5O
IUPAC name1-[3-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]phenyl]-1,3-diazinan-2-one
Molecular weight429.568
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.8
SynonymsN/A
Inchi KeyBCEHGFDIYZMEPU-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H31N5O/c1-20-9-10-23-24(28-20)7-3-8-25(23)30-17-15-29(16-18-30)14-11-21-5-2-6-22(19-21)31-13-4-12-27-26(31)32/h2-3,5-10,19H,4,11-18H2,1H3,(H,27,32)
PubChem CID49850769
ChEMBLCHEMBL1631541
IUPHARN/A
BindingDBN/A
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
200945-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
200925-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
200935-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377

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