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canSAR1141766
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NAMES
    SMILES
    COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NC(=S)Nc2ccc(C)cc2)cc1
    InChI
    InChI=1S/C25H22N4O2S/c1-17-8-12-19(13-9-17)26-25(32)27-24(30)22-16-29(20-6-4-3-5-7-20)28-23(22)18-10-14-21(31-2)15-11-18/h3-16H,1-2H3,(H2,26,27,30,32)
    MOLECULAR FORMULA
    C25H22N4O2S
    CROSS REFERENCES
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    canSAR1141766

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.15
    AlogP 4.98
    HBond donors 2
    HBond acceptors 6
    Atoms 54
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1141766.