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canSAR1523744
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NAMES
    SMILES
    COCc1cc(C)nc(SCc2ccc([N+](=O)[O-])cc2)c1C#N
    InChI
    InChI=1S/C16H15N3O3S/c1-11-7-13(9-22-2)15(8-17)16(18-11)23-10-12-3-5-14(6-4-12)19(20)21/h3-7H,9-10H2,1-2H3
    MOLECULAR FORMULA
    C16H15N3O3S
    CROSS REFERENCES
    1523744 logo

    canSAR1523744

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 329.08
    AlogP 3.61
    HBond donors 0
    HBond acceptors 6
    Atoms 38
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1523744.