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canSAR1518614
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NAMES
    SMILES
    CC(C)c1cc(C(C)C)c(S(=O)(=O)Nc2ccc(/C=C/C(=O)NO)cc2)c(C(C)C)c1
    InChI
    InChI=1S/C24H32N2O4S/c1-15(2)19-13-21(16(3)4)24(22(14-19)17(5)6)31(29,30)26-20-10-7-18(8-11-20)9-12-23(27)25-28/h7-17,26,28H,1-6H3,(H,25,27)/b12-9+
    MOLECULAR FORMULA
    C24H32N2O4S
    CROSS REFERENCES
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    canSAR1518614

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.21
    AlogP 5.38
    HBond donors 3
    HBond acceptors 6
    Atoms 63
    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 canSAR1518614.