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Ligand

NameJMC516547 Compound 5
Molecular formulaC15H16N6
IUPAC name4-(2-amino-6-piperazin-1-ylpyrimidin-4-yl)benzonitrile
Molecular weight280.335
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP1.0
SynonymsCHEMBL494890
SCHEMBL2166460
2-Aminopyrimidine analog., 25
BDBM26230
4-[2-amino-6-(piperazin-1-yl)pyrimidin-4-yl]benzonitrile
Inchi KeyGXPQVRIHPFBPOG-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H16N6/c16-10-11-1-3-12(4-2-11)13-9-14(20-15(17)19-13)21-7-5-18-6-8-21/h1-4,9,18H,5-8H2,(H2,17,19,20)
PubChem CID25130576
ChEMBLCHEMBL494890
IUPHARN/A
BindingDB26230
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
107815Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
107818Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445
107814Histamine H4 receptorQ91ZY2Hrh4Mus musculus (Mouse)391
107816Histamine H4 receptorQ9H3N8HRH4Homo sapiens (Human)390
107817Histamine H4 receptorQ91ZY1Hrh4Rattus norvegicus (Rat)391

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