canSAR1808861
FEATURES
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NAMES
    SMILES
    O=C(OCC[C@H]1CCn2cc([N+](=O)[O-])nc2O1)OCc1ccccc1OC(F)(F)F
    InChI
    InChI=1S/C17H16F3N3O7/c18-17(19,20)30-13-4-2-1-3-11(13)10-28-16(24)27-8-6-12-5-7-22-9-14(23(25)26)21-15(22)29-12/h1-4,9,12H,5-8,10H2/t12-/m1/s1
    MOLECULAR FORMULA
    C17H16F3N3O7
    CROSS REFERENCES
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    canSAR1808861
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight431.09
    AlogP3.58
    HBond donors0
    HBond acceptors10
    Atoms46
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1808861.