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canSAR1589999
FEATURES
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NAMES
    SMILES
    CCC(=O)NC(=S)Nc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1
    InChI
    InChI=1S/C18H18N4O5S/c1-2-16(23)21-18(28)20-13-5-3-12(4-6-13)19-17(24)11-27-15-9-7-14(8-10-15)22(25)26/h3-10H,2,11H2,1H3,(H,19,24)(H2,20,21,23,28)
    MOLECULAR FORMULA
    C18H18N4O5S
    CROSS REFERENCES
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    canSAR1589999

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.10
    AlogP 2.84
    HBond donors 3
    HBond acceptors 9
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1589999.