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canSAR1969807
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NAMES
    SMILES
    Cc1cc(C)c(NC(=O)CSc2nc3ccc(NC(=O)CSc4nnnn4-c4ccccc4)cc3s2)c(C)c1
    InChI
    InChI=1S/C27H25N7O2S3/c1-16-11-17(2)25(18(3)12-16)30-24(36)15-38-27-29-21-10-9-19(13-22(21)39-27)28-23(35)14-37-26-31-32-33-34(26)20-7-5-4-6-8-20/h4-13H,14-15H2,1-3H3,(H,28,35)(H,30,36)
    MOLECULAR FORMULA
    C27H25N7O2S3
    CROSS REFERENCES
    1969807 logo

    canSAR1969807

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 575.12
    AlogP 5.66
    HBond donors 2
    HBond acceptors 9
    Atoms 64
    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 canSAR1969807.