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canSAR989326
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NAMES
    SMILES
    CCC(c1nc2sccc2c(=O)n1Cc1ccccc1)N(CCCN)C(=O)c1ccc(C)cc1
    InChI
    InChI=1S/C27H30N4O2S/c1-3-23(30(16-7-15-28)26(32)21-12-10-19(2)11-13-21)24-29-25-22(14-17-34-25)27(33)31(24)18-20-8-5-4-6-9-20/h4-6,8-14,17,23H,3,7,15-16,18,28H2,1-2H3
    MOLECULAR FORMULA
    C27H30N4O2S
    CROSS REFERENCES
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    canSAR989326

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 474.21
    AlogP 4.76
    HBond donors 2
    HBond acceptors 6
    Atoms 64
    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 canSAR989326.