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canSAR559528
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NAMES
    SMILES
    C/C=C/N1CCc2c(cc(OC(C)=O)c(OC(C)=O)c2Cl)C(c2ccccc2)C1.Cl
    InChI
    InChI=1S/C23H24ClNO4.ClH/c1-4-11-25-12-10-18-19(20(14-25)17-8-6-5-7-9-17)13-21(28-15(2)26)23(22(18)24)29-16(3)27;/h4-9,11,13,20H,10,12,14H2,1-3H3;1H/b11-4+;
    MOLECULAR FORMULA
    C23H25Cl2NO4
    CROSS REFERENCES
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    canSAR559528

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 449.12
    AlogP 5.14
    HBond donors 0
    HBond acceptors 5
    Atoms 55
    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 canSAR559528.