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Ligand

NameCHEMBL1162555
Molecular formulaC12H20N4O12P2
IUPAC nameazane;[2-cyanoethoxy(hydroxy)phosphoryl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
Molecular weight474.256
Hydrogen bond acceptor14
Hydrogen bond donor6
XlogPNone
SynonymsN/A
Inchi KeyRCYDVSRZDMGZOO-VYFIMUGFSA-N
Inchi IDInChI=1S/C12H17N3O12P2.H3N/c13-3-1-5-24-28(20,21)27-29(22,23)25-6-7-9(17)10(18)11(26-7)15-4-2-8(16)14-12(15)19;/h2,4,7,9-11,17-18H,1,5-6H2,(H,20,21)(H,22,23)(H,14,16,19);1H3/t7-,9-,10-,11-;/m1./s1
PubChem CID44627594
ChEMBLCHEMBL1162555
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.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
293168P2Y purinoceptor 14Q15391P2RY14Homo sapiens (Human)338
293167P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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