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canSAR1765828
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NAMES
    SMILES
    COc1ccccc1N1CCN(c2cc(=O)n(-c3ccc(Cl)cc3)c(=O)[nH]2)CC1
    InChI
    InChI=1S/C21H21ClN4O3/c1-29-18-5-3-2-4-17(18)24-10-12-25(13-11-24)19-14-20(27)26(21(28)23-19)16-8-6-15(22)7-9-16/h2-9,14H,10-13H2,1H3,(H,23,28)
    MOLECULAR FORMULA
    C21H21ClN4O3
    CROSS REFERENCES
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    canSAR1765828

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.13
    AlogP 2.51
    HBond donors 1
    HBond acceptors 7
    Atoms 50
    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 canSAR1765828.