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canSAR1155373
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NAMES
    SMILES
    C[C@]12CCOC[C@@H]1[C@]1(COC(N)=N1)c1cc(-c3cncc(Cl)c3)c(F)cc1O2
    InChI
    InChI=1S/C20H19ClFN3O3/c1-19-2-3-26-9-17(19)20(10-27-18(23)25-20)14-5-13(15(22)6-16(14)28-19)11-4-12(21)8-24-7-11/h4-8,17H,2-3,9-10H2,1H3,(H2,23,25)/t17-,19-,20-/m0/s1
    MOLECULAR FORMULA
    C20H19ClFN3O3
    CROSS REFERENCES
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    canSAR1155373

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.11
    AlogP 3.27
    HBond donors 2
    HBond acceptors 6
    Atoms 47
    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 canSAR1155373.