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Ligand

NameCHEMBL3634184
Molecular formulaC10H15ClN5O12P3S
IUPAC name[[(2R,3S,4R,5R)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl] phosphono hydrogen phosphate
Molecular weight557.684
Hydrogen bond acceptor17
Hydrogen bond donor7
XlogP-3.0
SynonymsBDBM50131062
Inchi KeyIZZLFNBHULBCLL-AESZWTTRSA-N
Inchi IDInChI=1S/C10H15ClN5O12P3S/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(18)5(17)3(26-9)1-25-31(24,32)28-30(22,23)27-29(19,20)21/h2-3,5-6,9,17-18H,1H2,(H,22,23)(H,24,32)(H2,12,14,15)(H2,19,20,21)/t3-,5-,6-,9-,31?/m1/s1
PubChem CID122195893
ChEMBLCHEMBL3634184
IUPHARN/A
BindingDB50131062
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.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
480927P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373
480928P2Y purinoceptor 11Q96G91P2RY11Homo sapiens (Human)374

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