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Ligand

NameCHEMBL609776
Molecular formulaC18H29N7O4
IUPAC name(2S,3S,4R)-N-(8-aminooctyl)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-carboxamide
Molecular weight407.475
Hydrogen bond acceptor9
Hydrogen bond donor5
XlogP0.5
SynonymsBDBM50369930
Inchi KeyOOPDCKNKYVGROT-CDJKEZFESA-N
Inchi IDInChI=1S/C18H29N7O4/c19-7-5-3-1-2-4-6-8-21-17(28)14-12(26)13(27)18(29-14)25-10-24-11-15(20)22-9-23-16(11)25/h9-10,12-14,18,26-27H,1-8,19H2,(H,21,28)(H2,20,22,23)/t12-,13+,14-,18?/m0/s1
PubChem CID46875349
ChEMBLCHEMBL609776
IUPHARN/A
BindingDB50369930
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2465172-oxoglutarate receptor 1Q6Y1R5Oxgr1Rattus norvegicus (Rat)337

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