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canSAR1716577
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)CSc2nnc(NC(=O)C3CC(=O)N(c4cccc(OC)c4)C3)s2)cc1
    InChI
    InChI=1S/C23H22N4O5S2/c1-31-17-8-6-14(7-9-17)19(28)13-33-23-26-25-22(34-23)24-21(30)15-10-20(29)27(12-15)16-4-3-5-18(11-16)32-2/h3-9,11,15H,10,12-13H2,1-2H3,(H,24,25,30)
    MOLECULAR FORMULA
    C23H22N4O5S2
    CROSS REFERENCES
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    canSAR1716577

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 498.10
    AlogP 3.52
    HBond donors 1
    HBond acceptors 9
    Atoms 56
    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 canSAR1716577.