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canSAR1489921
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NAMES
    SMILES
    Cc1cc(-c2c(Cl)cccc2Cl)cc2nnc(Nc3ccc(S(=O)(=O)N(C)CCN4CCCC4)cc3)nc12
    InChI
    InChI=1S/C27H28Cl2N6O2S/c1-18-16-19(25-22(28)6-5-7-23(25)29)17-24-26(18)31-27(33-32-24)30-20-8-10-21(11-9-20)38(36,37)34(2)14-15-35-12-3-4-13-35/h5-11,16-17H,3-4,12-15H2,1-2H3,(H,30,31,33)
    MOLECULAR FORMULA
    C27H28Cl2N6O2S
    CROSS REFERENCES
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    canSAR1489921

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 570.14
    AlogP 5.77
    HBond donors 1
    HBond acceptors 8
    Atoms 66
    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 canSAR1489921.