canSAR1774028
FEATURES
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NAMES
    SMILES
    CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2ccc(CN3CCN(C)CC3)c(F)c2)n1
    InChI
    InChI=1S/C24H33FN6O2/c1-16(2)21-15-33-24(32)31(21)22-7-8-26-23(28-22)27-17(3)18-5-6-19(20(25)13-18)14-30-11-9-29(4)10-12-30/h5-8,13,16-17,21H,9-12,14-15H2,1-4H3,(H,26,27,28)/t17-,21+/m0/s1
    MOLECULAR FORMULA
    C24H33FN6O2
    CROSS REFERENCES
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    canSAR1774028
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight456.26
    AlogP3.52
    HBond donors1
    HBond acceptors8
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1774028.