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canSAR1512643
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NAMES
    SMILES
    CC1=NOC(=O)/C1=C/c1c(COCc2ccc(C(F)(F)F)cc2)n(C)c2ccc(F)cc12
    InChI
    InChI=1S/C23H18F4N2O3/c1-13-17(22(30)32-28-13)10-19-18-9-16(24)7-8-20(18)29(2)21(19)12-31-11-14-3-5-15(6-4-14)23(25,26)27/h3-10H,11-12H2,1-2H3/b17-10+
    MOLECULAR FORMULA
    C23H18F4N2O3
    CROSS REFERENCES
    1512643 logo

    canSAR1512643

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.13
    AlogP 5.37
    HBond donors 0
    HBond acceptors 5
    Atoms 50
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1512643.