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canSAR1112346
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NAMES
    SMILES
    COc1ccc(-c2cc3c(OC(=O)c4ccc([N+](=O)[O-])cc4)cccc3o2)cc1
    InChI
    InChI=1S/C22H15NO6/c1-27-17-11-7-14(8-12-17)21-13-18-19(28-21)3-2-4-20(18)29-22(24)15-5-9-16(10-6-15)23(25)26/h2-13H,1H3
    MOLECULAR FORMULA
    C22H15NO6
    CROSS REFERENCES
    1112346 logo

    canSAR1112346

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 389.09
    AlogP 5.24
    HBond donors 0
    HBond acceptors 7
    Atoms 44
    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 canSAR1112346.