canSAR1746605
FEATURES
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NAMES
    SMILES
    COc1ccccc1OCC(=O)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3
    InChI
    InChI=1S/C21H20N4O5/c1-29-16-5-2-3-6-17(16)30-12-19(26)23-24-20(27)13-8-9-14-15(11-13)22-18-7-4-10-25(18)21(14)28/h2-3,5-6,8-9,11H,4,7,10,12H2,1H3,(H,23,26)(H,24,27)
    MOLECULAR FORMULA
    C21H20N4O5
    CROSS REFERENCES
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    canSAR1746605
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight408.14
    AlogP1.19
    HBond donors2
    HBond acceptors9
    Atoms50
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746605.