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canSAR1765391
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NAMES
    SMILES
    COc1ccc2c(c1)CCc1c(C(=O)Nc3cc(OC)c(Cl)cc3OC)noc1-2
    InChI
    InChI=1S/C21H19ClN2O5/c1-26-12-5-7-13-11(8-12)4-6-14-19(24-29-20(13)14)21(25)23-16-10-17(27-2)15(22)9-18(16)28-3/h5,7-10H,4,6H2,1-3H3,(H,23,25)
    MOLECULAR FORMULA
    C21H19ClN2O5
    CROSS REFERENCES
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    canSAR1765391

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 414.10
    AlogP 4.37
    HBond donors 1
    HBond acceptors 7
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1765391.