canSAR1709194
FEATURES
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NAMES
    SMILES
    Cc1ccc(S(=O)(=O)N(C)C[C@@H]2Oc3c(NC(=O)c4ccc(-c5nccs5)cc4)cccc3C(=O)N([C@@H](C)CO)C[C@@H]2C)cc1
    InChI
    InChI=1S/C33H36N4O6S2/c1-21-8-14-26(15-9-21)45(41,42)36(4)19-29-22(2)18-37(23(3)20-38)33(40)27-6-5-7-28(30(27)43-29)35-31(39)24-10-12-25(13-11-24)32-34-16-17-44-32/h5-17,22-23,29,38H,18-20H2,1-4H3,(H,35,39)/t22-,23-,29-/m0/s1
    MOLECULAR FORMULA
    C33H36N4O6S2
    CROSS REFERENCES
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    canSAR1709194
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight648.21
    AlogP4.91
    HBond donors2
    HBond acceptors10
    Atoms81
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1709194.