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canSAR1430610
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NAMES
    SMILES
    COc1cc(OC)cc(-c2nc3n(n2)C(c2ccccc2F)C(C(=O)Nc2cccnc2)=C(C)N3)c1
    InChI
    InChI=1S/C26H23FN6O3/c1-15-22(25(34)30-17-7-6-10-28-14-17)23(20-8-4-5-9-21(20)27)33-26(29-15)31-24(32-33)16-11-18(35-2)13-19(12-16)36-3/h4-14,23H,1-3H3,(H,30,34)(H,29,31,32)
    MOLECULAR FORMULA
    C26H23FN6O3
    CROSS REFERENCES
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    canSAR1430610

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 486.18
    AlogP 4.42
    HBond donors 2
    HBond acceptors 9
    Atoms 59
    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 canSAR1430610.