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Ligand

NameSCHEMBL16222656
Molecular formulaC20H23ClN6O2S
IUPAC name6-[2-tert-butyl-9-[(3-chloropyridin-2-yl)methyl]purin-6-yl]-2lambda6-thia-6-azaspiro[3.3]heptane 2,2-dioxide
Molecular weight446.954
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP2.4
SynonymsAELZTFHFDZRLAS-UHFFFAOYSA-N
US9505762, 162
6-[2-tert-butyl-9-[(3-chloropyridin-2-yl)methyl]purin-6-yl]-2lambda6-thia-6-azaspiro[3.3]heptane 2,2-dioxide
Inchi KeyAELZTFHFDZRLAS-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H23ClN6O2S/c1-19(2,3)18-24-16-15(23-12-26(16)7-14-13(21)5-4-6-22-14)17(25-18)27-8-20(9-27)10-30(28,29)11-20/h4-6,12H,7-11H2,1-3H3
PubChem CID117687337
ChEMBLN/A
IUPHARN/A
BindingDB259794
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
536007Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
536006Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360

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