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canSAR1834721
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NAMES
    SMILES
    COc1ccc(C2CC(c3ccccc3)Nc3nc(NC(=O)c4cccs4)nn32)cc1
    InChI
    InChI=1S/C23H21N5O2S/c1-30-17-11-9-16(10-12-17)19-14-18(15-6-3-2-4-7-15)24-23-26-22(27-28(19)23)25-21(29)20-8-5-13-31-20/h2-13,18-19H,14H2,1H3,(H2,24,25,26,27,29)
    MOLECULAR FORMULA
    C23H21N5O2S
    CROSS REFERENCES
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    canSAR1834721

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.14
    AlogP 4.75
    HBond donors 2
    HBond acceptors 7
    Atoms 52
    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 canSAR1834721.