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canSAR1966652
FEATURES
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NAMES
    SMILES
    Cc1sc2ncn(CC(=O)Nc3cccc(C(F)(F)F)c3)c(=O)c2c1S(=O)(=O)N1CCN(C)CC1
    InChI
    InChI=1S/C21H22F3N5O4S2/c1-13-18(35(32,33)29-8-6-27(2)7-9-29)17-19(34-13)25-12-28(20(17)31)11-16(30)26-15-5-3-4-14(10-15)21(22,23)24/h3-5,10,12H,6-9,11H2,1-2H3,(H,26,30)
    MOLECULAR FORMULA
    C21H22F3N5O4S2
    CROSS REFERENCES
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    canSAR1966652

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 529.11
    AlogP 2.36
    HBond donors 1
    HBond acceptors 9
    Atoms 57
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1966652.