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Ligand

NameCHEMBL1957448
Molecular formulaC12H15N2O7P-2
IUPAC name1-[(1S,2R,3S,4R,5S)-3,4-dihydroxy-5-(2-phosphonatoethyl)-2-bicyclo[3.1.0]hexanyl]pyrimidine-2,4-dione
Molecular weight330.233
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP-3.3
SynonymsBDBM50366146
Inchi KeyFUFOHGCOOQKEEN-PHXRMZQKSA-L
Inchi IDInChI=1S/C12H17N2O7P/c15-7-1-3-14(11(18)13-7)8-6-5-12(6,10(17)9(8)16)2-4-22(19,20)21/h1,3,6,8-10,16-17H,2,4-5H2,(H,13,15,18)(H2,19,20,21)/p-2/t6-,8-,9+,10+,12-/m1/s1
PubChem CID91930227
ChEMBLN/A
IUPHARN/A
BindingDB50366146
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
459996P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377

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