canSAR739799
FEATURES
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NAMES
    SMILES
    CCOc1ccc(CC(=O)OC[C@@H]2[C@H](CC)C(=O)N2Cc2ccc(S(=O)(=O)O)cc2)cc1OCC
    InChI
    InChI=1S/C25H31NO8S/c1-4-20-21(26(25(20)28)15-17-7-10-19(11-8-17)35(29,30)31)16-34-24(27)14-18-9-12-22(32-5-2)23(13-18)33-6-3/h7-13,20-21H,4-6,14-16H2,1-3H3,(H,29,30,31)/t20-,21+/m0/s1
    MOLECULAR FORMULA
    C25H31NO8S
    CROSS REFERENCES
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    canSAR739799
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight505.18
    AlogP3.25
    HBond donors1
    HBond acceptors9
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR739799.