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Ligand

NameCHEMBL611792
Molecular formulaC19H33N3O11P2S
IUPAC name[but-3-ynoxy(hydroxy)phosphoryl] [(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methyl hydrogen phosphate;N,N-diethylethanamine
Molecular weight573.491
Hydrogen bond acceptor13
Hydrogen bond donor5
XlogPNone
SynonymsN/A
Inchi KeyLHLKVQYFKILFNG-WNEHWFFFSA-N
Inchi IDInChI=1S/C13H18N2O11P2S.C6H15N/c1-2-3-6-23-27(19,20)26-28(21,22)24-7-8-10(17)11(18)12(25-8)15-5-4-9(16)14-13(15)29;1-4-7(5-2)6-3/h1,4-5,8,10-12,17-18H,3,6-7H2,(H,19,20)(H,21,22)(H,14,16,29);4-6H2,1-3H3/t8-,10-,11-,12-;/m1./s1
PubChem CID44627598
ChEMBLCHEMBL611792
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis 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
187629P2Y purinoceptor 14Q15391P2RY14Homo sapiens (Human)338
187628P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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