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canSAR1859769
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NAMES
    SMILES
    COc1ccnc(-c2ccn3c(-c4cccc(NC(=O)NCC(F)(F)F)c4)cnc3c2)n1
    InChI
    InChI=1S/C21H17F3N6O2/c1-32-18-5-7-25-19(29-18)14-6-8-30-16(11-26-17(30)10-14)13-3-2-4-15(9-13)28-20(31)27-12-21(22,23)24/h2-11H,12H2,1H3,(H2,27,28,31)
    MOLECULAR FORMULA
    C21H17F3N6O2
    CROSS REFERENCES
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    canSAR1859769

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.14
    AlogP 4.15
    HBond donors 2
    HBond acceptors 8
    Atoms 49
    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 canSAR1859769.