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canSAR1402839
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)NNC(=O)CSc2nnc(C3CC3)n2C)cc1
    InChI
    InChI=1S/C16H19N5O3S/c1-21-14(10-3-4-10)18-20-16(21)25-9-13(22)17-19-15(23)11-5-7-12(24-2)8-6-11/h5-8,10H,3-4,9H2,1-2H3,(H,17,22)(H,19,23)
    MOLECULAR FORMULA
    C16H19N5O3S
    CROSS REFERENCES
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    canSAR1402839

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.12
    AlogP 1.25
    HBond donors 2
    HBond acceptors 8
    Atoms 44
    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 canSAR1402839.