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canSAR1619541
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NAMES
    SMILES
    Nc1cnc(-c2ccc(C3CCC3)c(OCc3c(F)cccc3F)c2F)cn1
    InChI
    InChI=1S/C21H18F3N3O/c22-16-5-2-6-17(23)15(16)11-28-21-13(12-3-1-4-12)7-8-14(20(21)24)18-9-27-19(25)10-26-18/h2,5-10,12H,1,3-4,11H2,(H2,25,27)
    MOLECULAR FORMULA
    C21H18F3N3O
    CROSS REFERENCES
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    canSAR1619541

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.14
    AlogP 4.99
    HBond donors 2
    HBond acceptors 4
    Atoms 46
    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 canSAR1619541.