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Ligand

NameSCHEMBL3778815
Molecular formulaC13H21N5O2
IUPAC nametert-butyl (3R)-3-[(2-aminopyrimidin-4-yl)amino]pyrrolidine-1-carboxylate
Molecular weight279.344
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP1.3
SynonymsCHEMBL3694834
BDBM128111
US8796297, 17
Inchi KeyANCRHFIYTPCEEZ-SECBINFHSA-N
Inchi IDInChI=1S/C13H21N5O2/c1-13(2,3)20-12(19)18-7-5-9(8-18)16-10-4-6-15-11(14)17-10/h4,6,9H,5,7-8H2,1-3H3,(H3,14,15,16,17)/t9-/m1/s1
PubChem CID49857009
ChEMBLCHEMBL3694834
IUPHARN/A
BindingDB128111
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
9453Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
9454Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445

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