canSAR1602098
FEATURES
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NAMES
    SMILES
    COCCN1CC(C)(C)Oc2nc(N3CCOC[C@@H]3C)nc(-c3ccc(NC(=O)Nc4ccc(F)cc4F)cc3)c2C1=O
    InChI
    InChI=1S/C30H34F2N6O5/c1-18-16-42-14-12-38(18)28-35-25(24-26(36-28)43-30(2,3)17-37(27(24)39)11-13-41-4)19-5-8-21(9-6-19)33-29(40)34-23-10-7-20(31)15-22(23)32/h5-10,15,18H,11-14,16-17H2,1-4H3,(H2,33,34,40)/t18-/m0/s1
    MOLECULAR FORMULA
    C30H34F2N6O5
    CROSS REFERENCES
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    canSAR1602098
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight596.26
    AlogP4.55
    HBond donors2
    HBond acceptors11
    Atoms77
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1602098.