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Ligand

NameCHEMBL3634183
Molecular formulaC10H14ClN5O9P2S
IUPAC name[[(2R,3S,4R,5R)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl] dihydrogen phosphate
Molecular weight477.706
Hydrogen bond acceptor14
Hydrogen bond donor6
XlogP-1.9
SynonymsBDBM50131063
Inchi KeyJYRNKRQKTHSDQB-PIORMBHWSA-N
Inchi IDInChI=1S/C10H14ClN5O9P2S/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(18)5(17)3(24-9)1-23-27(22,28)25-26(19,20)21/h2-3,5-6,9,17-18H,1H2,(H,22,28)(H2,12,14,15)(H2,19,20,21)/t3-,5-,6-,9-,27?/m1/s1
PubChem CID122195892
ChEMBLCHEMBL3634183
IUPHARN/A
BindingDB50131063
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
483064P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373
483063P2Y purinoceptor 11Q96G91P2RY11Homo sapiens (Human)374

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