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canSAR1268183
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NAMES
    SMILES
    C[n+]1cn([C@@H]2O[C@H](COP(=O)([O-])O)[C@@H](O)[C@H]2O)c2nc(NCc3ccc([N+](=O)[O-])cc3)[nH]c(=O)c21
    InChI
    InChI=1S/C18H21N6O10P/c1-22-8-23(17-14(26)13(25)11(34-17)7-33-35(30,31)32)15-12(22)16(27)21-18(20-15)19-6-9-2-4-10(5-3-9)24(28)29/h2-5,8,11,13-14,17,25-26H,6-7H2,1H3,(H3-,19,20,21,27,30,31,32)/t11-,13-,14-,17-/m1/s1
    MOLECULAR FORMULA
    C18H21N6O10P
    CROSS REFERENCES
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    canSAR1268183

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 512.11
    AlogP -1.83
    HBond donors 5
    HBond acceptors 16
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1268183.