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canSAR1954599
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NAMES
    SMILES
    CC(C)(C)c1ccc(CSc2nnc(-c3ccccn3)n2Cc2ccco2)cc1
    InChI
    InChI=1S/C23H24N4OS/c1-23(2,3)18-11-9-17(10-12-18)16-29-22-26-25-21(20-8-4-5-13-24-20)27(22)15-19-7-6-14-28-19/h4-14H,15-16H2,1-3H3
    MOLECULAR FORMULA
    C23H24N4OS
    CROSS REFERENCES
    1954599 logo

    canSAR1954599

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.17
    AlogP 5.57
    HBond donors 0
    HBond acceptors 5
    Atoms 53
    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 canSAR1954599.