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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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Ligand

NameASN 04426639
Molecular formulaC16H25N5O3S
IUPAC name1,3-dimethyl-8-(2-morpholin-4-ylethylsulfanyl)-7-propylpurine-2,6-dione
Molecular weight367.468
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP0.9
Synonyms1,3-Dimethyl-8-(2-morpholin-4-yl-ethylsulfanyl)-7-propyl-3,7-dihydro-purine-2,6-dione
CHEMBL1529195
HMS2832M05
MLS001212826
Oprea1_358535
[ Show all ]
Inchi KeyADAQIYFLSZAPAL-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H25N5O3S/c1-4-5-21-12-13(18(2)16(23)19(3)14(12)22)17-15(21)25-11-8-20-6-9-24-10-7-20/h4-11H2,1-3H3
PubChem CID1173803
ChEMBLCHEMBL1529195
IUPHARN/A
BindingDBN/A
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2087Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
463191Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
2086Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757

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