canSAR586279
FEATURES
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NAMES
    SMILES
    CC(C)(CNCc1ccc(C(F)(F)F)cc1)c1nc(-c2ccnc(N)n2)c(-c2ccc(Cl)c(O)c2)[nH]1
    InChI
    InChI=1S/C25H24ClF3N6O/c1-24(2,13-31-12-14-3-6-16(7-4-14)25(27,28)29)22-34-20(15-5-8-17(26)19(36)11-15)21(35-22)18-9-10-32-23(30)33-18/h3-11,31,36H,12-13H2,1-2H3,(H,34,35)(H2,30,32,33)
    MOLECULAR FORMULA
    C25H24ClF3N6O
    CROSS REFERENCES
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    canSAR586279
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight516.17
    AlogP5.56
    HBond donors5
    HBond acceptors7
    Atoms60
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR586279.