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Ligand

Name[33P]2-methylthio-ADP
Molecular formulaC11H17N5O10P2S
IUPAC name[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydroxy(33P)phosphoryl hydrogen phosphate
Molecular weight477.285
Hydrogen bond acceptor15
Hydrogen bond donor6
XlogP-3.8
SynonymsD08WNN
GTPL1774
[33P]2MeSADP
Inchi KeyWLMZTKAZJUWXCB-JLOOSCHCSA-N
Inchi IDInChI=1S/C11H17N5O10P2S/c1-29-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(25-10)2-24-28(22,23)26-27(19,20)21/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H2,12,14,15)(H2,19,20,21)/t4-,6-,7-,10-/m1/s1/i27+2,28+2
PubChem CID73755009
ChEMBLN/A
IUPHAR1774
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
555165P2Y purinoceptor 13Q9BPV8P2RY13Homo sapiens (Human)354

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