canSAR2150580
FEATURES
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NAMES
    SMILES
    CC(C)(C)c1ccc(Nc2nc(N3CCCCC3)nc3c2CCN(c2ncccc2C(F)(F)F)CC3)cc1[N+](=O)[O-]
    InChI
    InChI=1S/C29H34F3N7O2/c1-28(2,3)21-10-9-19(18-24(21)39(40)41)34-25-20-11-16-37(26-22(29(30,31)32)8-7-13-33-26)17-12-23(20)35-27(36-25)38-14-5-4-6-15-38/h7-10,13,18H,4-6,11-12,14-17H2,1-3H3,(H,34,35,36)
    MOLECULAR FORMULA
    C29H34F3N7O2
    CROSS REFERENCES
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    canSAR2150580
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight569.27
    AlogP6.44
    HBond donors1
    HBond acceptors9
    Atoms75
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2150580.