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canSAR142927
FEATURES
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NAMES
    SMILES
    COC12[C@@H](COC(N)=O)c3c(O)c(N=C4C=CC(=NC(C)=O)C=C4)c(C)c(O)c3N1C[C@H]1N[C@H]12
    InChI
    InChI=1S/C23H25N5O6/c1-10-17(26-13-6-4-12(5-7-13)25-11(2)29)20(31)16-14(9-34-22(24)32)23(33-3)21-15(27-21)8-28(23)18(16)19(10)30/h4-7,14-15,21,27,30-31H,8-9H2,1-3H3,(H2,24,32)/b25-12-,26-13+/t14-,15+,21+,23?/m0/s1
    MOLECULAR FORMULA
    C23H25N5O6
    CROSS REFERENCES
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    canSAR142927

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 467.18
    AlogP 1.29
    HBond donors 5
    HBond acceptors 11
    Atoms 59
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR142927.