canSAR1529668
FEATURES
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NAMES
    SMILES
    COc1cccc(S(=O)(=O)N(C)C[C@@H]2Oc3cc(C4=CCCCC4)ccc3S(=O)(=O)N([C@H](C)CO)C[C@@H]2C)c1
    InChI
    InChI=1S/C28H38N2O7S2/c1-20-17-30(21(2)19-31)39(34,35)28-14-13-23(22-9-6-5-7-10-22)15-26(28)37-27(20)18-29(3)38(32,33)25-12-8-11-24(16-25)36-4/h8-9,11-16,20-21,27,31H,5-7,10,17-19H2,1-4H3/t20-,21+,27-/m0/s1
    MOLECULAR FORMULA
    C28H38N2O7S2
    CROSS REFERENCES
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    canSAR1529668
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight578.21
    AlogP3.74
    HBond donors1
    HBond acceptors9
    Atoms77
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1529668.