canSAR2098538
FEATURES
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NAMES
    SMILES
    Cc1ccc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCc2cccnc2)o1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C19H24N2O3.2C2HF3O2/c1-14-4-5-16(24-14)12-21-9-10-22-19-17(21)6-7-18(19)23-13-15-3-2-8-20-11-15;2*3-2(4,5)1(6)7/h2-5,8,11,17-19H,6-7,9-10,12-13H2,1H3;2*(H,6,7)/t17-,18+,19+;;/m0../s1
    MOLECULAR FORMULA
    C23H26F6N2O7
    CROSS REFERENCES
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    canSAR2098538
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight556.16
    AlogP4.20
    HBond donors2
    HBond acceptors9
    Atoms64
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2098538.