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Ligand

NameCHEMBL502138
Molecular formulaC42H60N6O2
IUPAC nameN,N'-bis[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]tetradecanediamide
Molecular weight680.982
Hydrogen bond acceptor4
Hydrogen bond donor4
XlogP8.3
SynonymsN1,N14-bis(3-(1-methylpiperidin-4-yl)-1H-indol-5-yl)tetradecanediamide
BDBM50271132
Inchi KeyNMIDHESOKKYAGZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C42H60N6O2/c1-47-23-19-31(20-24-47)37-29-43-39-17-15-33(27-35(37)39)45-41(49)13-11-9-7-5-3-4-6-8-10-12-14-42(50)46-34-16-18-40-36(28-34)38(30-44-40)32-21-25-48(2)26-22-32/h15-18,27-32,43-44H,3-14,19-26H2,1-2H3,(H,45,49)(H,46,50)
PubChem CID24881204
ChEMBLCHEMBL502138
IUPHARN/A
BindingDB50271132
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2268925-hydroxytryptamine receptor 1BP49144HTR1BOryctolagus cuniculus (Rabbit)390
2268935-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
2268915-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377

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