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Ligand

NameCHEMBL1077636
Molecular formulaC12H20N6
IUPAC name1-cyano-2-[4-(1H-imidazol-5-yl)butyl]-3-propan-2-ylguanidine
Molecular weight248.334
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP1.2
SynonymsBDBM50415659
2-Cyano-1-[4-(1H-imidazol-4-yl)butyl]-3-isopropylguanidine
1192560-03-4
Inchi KeyBWNYFRHMGXLSFD-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H20N6/c1-10(2)18-12(16-8-13)15-6-4-3-5-11-7-14-9-17-11/h7,9-10H,3-6H2,1-2H3,(H,14,17)(H2,15,16,18)
PubChem CID44480960
ChEMBLCHEMBL1077636
IUPHARN/A
BindingDB50415659
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34592Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
34591Histamine H2 receptorP25021HRH2Homo sapiens (Human)359
34593Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
34594Histamine H4 receptorQ9H3N8HRH4Homo sapiens (Human)390

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