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canSAR1618021
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NAMES
    SMILES
    COc1cc(/C(O)=C/C=Nc2ccc(NC(C)=O)cc2)cc(OC)c1OC
    InChI
    InChI=1S/C20H22N2O5/c1-13(23)22-16-7-5-15(6-8-16)21-10-9-17(24)14-11-18(25-2)20(27-4)19(12-14)26-3/h5-12,24H,1-4H3,(H,22,23)/b17-9-,21-10?
    MOLECULAR FORMULA
    C20H22N2O5
    CROSS REFERENCES
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    canSAR1618021

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 370.15
    AlogP 3.97
    HBond donors 2
    HBond acceptors 7
    Atoms 49
    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 canSAR1618021.