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canSAR989117
FEATURES
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NAMES
    SMILES
    COc1cccc(OC)c1Oc1nc[nH]c(=O)c1/C=C/C(C)=O
    InChI
    InChI=1S/C16H16N2O5/c1-10(19)7-8-11-15(20)17-9-18-16(11)23-14-12(21-2)5-4-6-13(14)22-3/h4-9H,1-3H3,(H,17,18,20)/b8-7+
    MOLECULAR FORMULA
    C16H16N2O5
    CROSS REFERENCES
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    canSAR989117

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 316.11
    AlogP 2.18
    HBond donors 1
    HBond acceptors 7
    Atoms 39
    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 canSAR989117.