canSAR1846483
FEATURES
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NAMES
    SMILES
    CCN1C(=O)[C@H]2[C@@H](C1=O)[C@@H](c1ccc(-c3cccc(Cl)c3)cc1)N[C@@]2(C)C(=O)OC.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C23H23ClN2O4.C2HF3O2/c1-4-26-20(27)17-18(21(26)28)23(2,22(29)30-3)25-19(17)14-10-8-13(9-11-14)15-6-5-7-16(24)12-15;3-2(4,5)1(6)7/h5-12,17-19,25H,4H2,1-3H3;(H,6,7)/t17-,18-,19-,23-;/m1./s1
    MOLECULAR FORMULA
    C25H24ClF3N2O6
    CROSS REFERENCES
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    canSAR1846483
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight540.13
    AlogP3.84
    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 canSAR1846483.