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Ligand

NameCHEMBL1162562
Molecular formulaC16H23N3O13P2
IUPAC nameazane;[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (4-methoxyphenyl) hydrogen phosphate
Molecular weight527.316
Hydrogen bond acceptor14
Hydrogen bond donor6
XlogPNone
SynonymsN/A
Inchi KeyNGJDHTAKGAEQBP-MOAMTLHQSA-N
Inchi IDInChI=1S/C16H20N2O13P2.H3N/c1-27-9-2-4-10(5-3-9)30-33(25,26)31-32(23,24)28-8-11-13(20)14(21)15(29-11)18-7-6-12(19)17-16(18)22;/h2-7,11,13-15,20-21H,8H2,1H3,(H,23,24)(H,25,26)(H,17,19,22);1H3/t11-,13-,14-,15-;/m1./s1
PubChem CID44627805
ChEMBLCHEMBL1162562
IUPHARN/A
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.
This ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
222686P2Y purinoceptor 14Q15391P2RY14Homo sapiens (Human)338
222685P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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