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Ligand

NameCHEMBL44408
Molecular formulaC10H14ClN5O9P2
IUPAC name[5-(6-amino-2-chloropurin-9-yl)-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate
Molecular weight445.646
Hydrogen bond acceptor13
Hydrogen bond donor5
XlogP-2.0
SynonymsPhosphoric acid mono-[5-(6-amino-2-chloro-purin-9-yl)-2-phosphonooxymethyl-tetrahydro-furan-3-yl] ester
BDBM50062286
Inchi KeyFCTUCHUTNSXNIZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C10H14ClN5O9P2/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(25-27(20,21)22)5(24-6)2-23-26(17,18)19/h3-6H,1-2H2,(H2,12,14,15)(H2,17,18,19)(H2,20,21,22)
PubChem CID44289130
ChEMBLN/A
IUPHARN/A
BindingDB50062286
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
520033P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362

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