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Ligand

NameCHEMBL1083258
Molecular formulaC15H25N2O15P3
IUPAC namecyclohexyl [[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate
Molecular weight566.285
Hydrogen bond acceptor15
Hydrogen bond donor6
XlogP-3.5
SynonymsCHEMBL1198837
BDBM50319138
P1-Uridine 5''-P3-Cyclohexyltriphosphate TriethylammoniumSalt
Inchi KeyDVFLQGLJTBCMRN-FMKGYKFTSA-N
Inchi IDInChI=1S/C15H25N2O15P3/c18-11-6-7-17(15(21)16-11)14-13(20)12(19)10(29-14)8-28-33(22,23)31-35(26,27)32-34(24,25)30-9-4-2-1-3-5-9/h6-7,9-10,12-14,19-20H,1-5,8H2,(H,22,23)(H,24,25)(H,26,27)(H,16,18,21)/t10-,12-,13-,14-/m1/s1
PubChem CID46830493
ChEMBLN/A
IUPHARN/A
BindingDB50319138
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
459854P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377
69885P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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