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canSAR1142593
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NAMES
    SMILES
    N=c1scc(-c2ccc(Cl)cc2)n1CC(=O)N1CCN(c2ccccc2)CC1
    InChI
    InChI=1S/C21H21ClN4OS/c22-17-8-6-16(7-9-17)19-15-28-21(23)26(19)14-20(27)25-12-10-24(11-13-25)18-4-2-1-3-5-18/h1-9,15,23H,10-14H2
    MOLECULAR FORMULA
    C21H21ClN4OS
    CROSS REFERENCES
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    canSAR1142593

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.11
    AlogP 3.70
    HBond donors 1
    HBond acceptors 5
    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 canSAR1142593.