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canSAR2090578
FEATURES
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NAMES
    SMILES
    COc1ccc(CN2C(=O)C[C@@H](c3ccccc3)[C@H]([N+](=O)[O-])[C@H]2c2ccc(O)cc2)cc1
    InChI
    InChI=1S/C25H24N2O5/c1-32-21-13-7-17(8-14-21)16-26-23(29)15-22(18-5-3-2-4-6-18)25(27(30)31)24(26)19-9-11-20(28)12-10-19/h2-14,22,24-25,28H,15-16H2,1H3/t22-,24+,25-/m0/s1
    MOLECULAR FORMULA
    C25H24N2O5
    CROSS REFERENCES
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    canSAR2090578

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.17
    AlogP 4.30
    HBond donors 1
    HBond acceptors 7
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2090578.