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Ligand

NameCHEMBL590494
Molecular formulaC9H13IN2O12P2
IUPAC name[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phosphono hydrogen phosphate
Molecular weight530.057
Hydrogen bond acceptor12
Hydrogen bond donor6
XlogP-4.4
SynonymsBDBM50306710
MRS-2695-I-UDP
5-iodouridine diphosphate
ZINC49746575
MRS-2695-iodo-UDP
[ Show all ]
Inchi KeyTTYCBCDSPQHLDE-UAKXSSHOSA-N
Inchi IDInChI=1S/C9H13IN2O12P2/c10-3-1-12(9(16)11-7(3)15)8-6(14)5(13)4(23-8)2-22-26(20,21)24-25(17,18)19/h1,4-6,8,13-14H,2H2,(H,20,21)(H,11,15,16)(H2,17,18,19)/t4-,5-,6-,8-/m1/s1
PubChem CID16007361
ChEMBLCHEMBL590494
IUPHARN/A
BindingDB50306710
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
327444P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328
327445Uracil nucleotide/cysteinyl leukotriene receptorQ13304GPR17Homo sapiens (Human)367

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