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canSAR1829846
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NAMES
    SMILES
    CN(C)[C@@H]1CC[C@@H](n2cc(C(N)=O)c(Nc3ccc(OC(F)F)nc3)n2)[C@H](C#N)C1
    InChI
    InChI=1S/C19H23F2N7O2/c1-27(2)13-4-5-15(11(7-13)8-22)28-10-14(17(23)29)18(26-28)25-12-3-6-16(24-9-12)30-19(20)21/h3,6,9-11,13,15,19H,4-5,7H2,1-2H3,(H2,23,29)(H,25,26)/t11-,13+,15+/m0/s1
    MOLECULAR FORMULA
    C19H23F2N7O2
    CROSS REFERENCES
    1829846 logo

    canSAR1829846

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.19
    AlogP 2.52
    HBond donors 3
    HBond acceptors 9
    Atoms 53
    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 canSAR1829846.