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canSAR1156341
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NAMES
    SMILES
    O=C(O)[C@@H]1CCCN1C(=O)c1cnc2cc(C(F)(F)F)ccc2c1O
    InChI
    InChI=1S/C16H13F3N2O4/c17-16(18,19)8-3-4-9-11(6-8)20-7-10(13(9)22)14(23)21-5-1-2-12(21)15(24)25/h3-4,6-7,12H,1-2,5H2,(H,20,22)(H,24,25)/t12-/m0/s1
    MOLECULAR FORMULA
    C16H13F3N2O4
    CROSS REFERENCES
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    canSAR1156341

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 354.08
    AlogP 2.65
    HBond donors 2
    HBond acceptors 6
    Atoms 38
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1156341.