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canSAR1123642
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NAMES
    SMILES
    CC(Sc1cc(-c2cnn(C)c2)cnc1N)c1c(Cl)ccc(F)c1Cl
    InChI
    InChI=1S/C17H15Cl2FN4S/c1-9(15-12(18)3-4-13(20)16(15)19)25-14-5-10(6-22-17(14)21)11-7-23-24(2)8-11/h3-9H,1-2H3,(H2,21,22)
    MOLECULAR FORMULA
    C17H15Cl2FN4S
    CROSS REFERENCES
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    canSAR1123642

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 396.04
    AlogP 5.36
    HBond donors 2
    HBond acceptors 4
    Atoms 40
    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 canSAR1123642.