canSAR2096326
FEATURES
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NAMES
    SMILES
    CO[C@H]1CCN(Cc2c(C)noc2C)[C@@H]2CN(Cc3ccncc3)C[C@H]12.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C20H28N4O2.3C2HF3O2/c1-14-17(15(2)26-22-14)12-24-9-6-20(25-3)18-11-23(13-19(18)24)10-16-4-7-21-8-5-16;3*3-2(4,5)1(6)7/h4-5,7-8,18-20H,6,9-13H2,1-3H3;3*(H,6,7)/t18-,19+,20-;;;/m0.../s1
    MOLECULAR FORMULA
    C26H31F9N4O8
    CROSS REFERENCES
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    canSAR2096326
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight698.20
    AlogP4.31
    HBond donors3
    HBond acceptors12
    Atoms78
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096326.