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Ligand

NameSNAP-5540
Molecular formulaC32H39N5O6
IUPAC namemethyl 1-[3-[[2,6-dimethyl-5-(methylcarbamoyl)-4-(4-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]amino]propyl]-4-phenylpiperidine-4-carboxylate
Molecular weight589.693
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP3.5
SynonymsN/A
Inchi KeyCAAOWRJNPRFDJE-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H39N5O6/c1-21-26(29(38)33-3)28(23-11-13-25(14-12-23)37(41)42)27(22(2)35-21)30(39)34-17-8-18-36-19-15-32(16-20-36,31(40)43-4)24-9-6-5-7-10-24/h5-7,9-14,28,35H,8,15-20H2,1-4H3,(H,33,38)(H,34,39)
PubChem CID10326069
ChEMBLCHEMBL147077
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 11
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
369975-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
369965-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
369885-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
369895-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
36990Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
36992Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
36991Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
36993Alpha-2B adrenergic receptorP18089ADRA2BHomo sapiens (Human)450
36995Alpha-2C adrenergic receptorP18825ADRA2CHomo sapiens (Human)462
36998Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
36994Histamine H2 receptorP25021HRH2Homo sapiens (Human)359

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