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canSAR106744
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NAMES
    SMILES
    CCCOc1cnc(CN/C=C2\C(=O)NC(=O)c3ccc(C(C)(C)C)cc32)cc1O
    InChI
    InChI=1S/C23H27N3O4/c1-5-8-30-20-13-25-15(10-19(20)27)11-24-12-18-17-9-14(23(2,3)4)6-7-16(17)21(28)26-22(18)29/h6-7,9-10,12-13,24H,5,8,11H2,1-4H3,(H,25,27)(H,26,28,29)/b18-12-
    MOLECULAR FORMULA
    C23H27N3O4
    CROSS REFERENCES
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    canSAR106744

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 409.20
    AlogP 3.27
    HBond donors 3
    HBond acceptors 7
    Atoms 57
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR106744.