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Ligand

NameVUF-8406
Molecular formulaC11H18N6S
IUPAC name1-cyano-2-[3-(1H-imidazol-5-yl)propyl]-3-(2-methylsulfanylethyl)guanidine
Molecular weight266.367
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP0.7
SynonymsCHEMBL12158
BDBM50406094
Inchi KeyBUFLTNKXAJNCHK-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H18N6S/c1-18-6-5-15-11(16-8-12)14-4-2-3-10-7-13-9-17-10/h7,9H,2-6H2,1H3,(H,13,17)(H2,14,15,16)
PubChem CID44267951
ChEMBLCHEMBL12158
IUPHARN/A
BindingDB50406094
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
32980Histamine H2 receptorP47747HRH2Cavia porcellus (Guinea pig)359
32981Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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