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Ligand

NameCHEMBL3236565
Molecular formulaC14H23N5O
IUPAC name(3S,4S)-1-(2-amino-6-cyclopentylpyrimidin-4-yl)-4-(methylamino)pyrrolidin-3-ol
Molecular weight277.372
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP0.8
SynonymsBDBM50006754
SCHEMBL605697
Inchi KeyADNLUQHYCDGVML-RYUDHWBXSA-N
Inchi IDInChI=1S/C14H23N5O/c1-16-11-7-19(8-12(11)20)13-6-10(17-14(15)18-13)9-4-2-3-5-9/h6,9,11-12,16,20H,2-5,7-8H2,1H3,(H2,15,17,18)/t11-,12-/m0/s1
PubChem CID24994636
ChEMBLCHEMBL3236565
IUPHARN/A
BindingDB50006754
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
2432Histamine H4 receptorQ9H3N8HRH4Homo sapiens (Human)390

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