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canSAR1769201
FEATURES
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NAMES
    SMILES
    CC(C)C(=O)Nc1ccc(C(=O)NNC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1
    InChI
    InChI=1S/C19H19N5O5S/c1-11(2)16(25)20-13-9-7-12(8-10-13)17(26)22-23-19(30)21-18(27)14-5-3-4-6-15(14)24(28)29/h3-11H,1-2H3,(H,20,25)(H,22,26)(H2,21,23,27,30)
    MOLECULAR FORMULA
    C19H19N5O5S
    CROSS REFERENCES
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    canSAR1769201

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.11
    AlogP 2.14
    HBond donors 4
    HBond acceptors 10
    Atoms 49
    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 canSAR1769201.