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canSAR652557
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NAMES
    SMILES
    COc1ccc(C2=C(c3cccs3)/C(=C/c3ccc(/C=C/C(=O)O)o3)NC2=O)cc1OC
    InChI
    InChI=1S/C24H19NO6S/c1-29-18-9-5-14(12-19(18)30-2)22-23(20-4-3-11-32-20)17(25-24(22)28)13-16-7-6-15(31-16)8-10-21(26)27/h3-13H,1-2H3,(H,25,28)(H,26,27)/b10-8+,17-13-
    MOLECULAR FORMULA
    C24H19NO6S
    CROSS REFERENCES
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    canSAR652557

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 449.09
    AlogP 4.54
    HBond donors 2
    HBond acceptors 7
    Atoms 51
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR652557.