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canSAR1501454
FEATURES
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NAMES
    SMILES
    Cn1c(Nc2c(Cl)ccc(CNC(=O)C(C)(C)C)c2Cl)nc2cc(C(=O)NCC(F)F)c(OCC(F)F)cc21
    InChI
    InChI=1S/C25H27Cl2F4N5O3/c1-25(2,3)23(38)33-9-12-5-6-14(26)21(20(12)27)35-24-34-15-7-13(22(37)32-10-18(28)29)17(39-11-19(30)31)8-16(15)36(24)4/h5-8,18-19H,9-11H2,1-4H3,(H,32,37)(H,33,38)(H,34,35)
    MOLECULAR FORMULA
    C25H27Cl2F4N5O3
    CROSS REFERENCES
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    canSAR1501454

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 591.14
    AlogP 5.92
    HBond donors 3
    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 canSAR1501454.