canSAR2064304
FEATURES
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NAMES
    SMILES
    N#Cc1cccc2nc(NC3CC3)c(N3CCN(Cc4cc(Cl)ccc4Cl)CC3)nc12.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C23H22Cl2N6.C2HF3O2/c24-17-4-7-19(25)16(12-17)14-30-8-10-31(11-9-30)23-22(27-18-5-6-18)28-20-3-1-2-15(13-26)21(20)29-23;3-2(4,5)1(6)7/h1-4,7,12,18H,5-6,8-11,14H2,(H,27,28);(H,6,7)
    MOLECULAR FORMULA
    C25H23Cl2F3N6O2
    CROSS REFERENCES
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    canSAR2064304
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight566.12
    AlogP5.34
    HBond donors2
    HBond acceptors8
    Atoms61
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2064304.