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canSAR1100815
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NAMES
    SMILES
    Cc1ccc(-c2noc(CSc3ncc(-c4ccncc4)n3-c3ccccc3C)n2)cc1
    InChI
    InChI=1S/C25H21N5OS/c1-17-7-9-20(10-8-17)24-28-23(31-29-24)16-32-25-27-15-22(19-11-13-26-14-12-19)30(25)21-6-4-3-5-18(21)2/h3-15H,16H2,1-2H3
    MOLECULAR FORMULA
    C25H21N5OS
    CROSS REFERENCES
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    canSAR1100815

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.15
    AlogP 5.89
    HBond donors 0
    HBond acceptors 6
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1100815.