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canSAR1126367
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NAMES
    SMILES
    COc1ccc2nc(Oc3ccc(C#N)cc3)c(C3C(C#N)=C(N)N(c4cccc(C(F)(F)F)c4)C4=C3C(=O)CCC4)cc2c1
    InChI
    InChI=1S/C34H24F3N5O3/c1-44-24-12-13-27-20(14-24)15-25(33(41-27)45-23-10-8-19(17-38)9-11-23)30-26(18-39)32(40)42(28-6-3-7-29(43)31(28)30)22-5-2-4-21(16-22)34(35,36)37/h2,4-5,8-16,30H,3,6-7,40H2,1H3
    MOLECULAR FORMULA
    C34H24F3N5O3
    CROSS REFERENCES
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    canSAR1126367

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 607.18
    AlogP 7.23
    HBond donors 2
    HBond acceptors 8
    Atoms 69
    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 canSAR1126367.