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canSAR778209
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NAMES
    SMILES
    COc1ccc2cc(-c3cccnc3)c(=O)oc2c1CCC(C)C
    InChI
    InChI=1S/C20H21NO3/c1-13(2)6-8-16-18(23-3)9-7-14-11-17(20(22)24-19(14)16)15-5-4-10-21-12-15/h4-5,7,9-13H,6,8H2,1-3H3
    MOLECULAR FORMULA
    C20H21NO3
    CROSS REFERENCES
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    canSAR778209

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 323.15
    AlogP 4.45
    HBond donors 0
    HBond acceptors 4
    Atoms 45
    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 canSAR778209.