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canSAR1533791
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NAMES
    SMILES
    COc1cccc(C2C3=C(CC(c4ccccc4)CC3=O)OC(=N)C2C#N)c1OC
    InChI
    InChI=1S/C24H22N2O4/c1-28-19-10-6-9-16(23(19)29-2)21-17(13-25)24(26)30-20-12-15(11-18(27)22(20)21)14-7-4-3-5-8-14/h3-10,15,17,21,26H,11-12H2,1-2H3
    MOLECULAR FORMULA
    C24H22N2O4
    CROSS REFERENCES
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    canSAR1533791

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.16
    AlogP 4.34
    HBond donors 1
    HBond acceptors 6
    Atoms 52
    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 canSAR1533791.