canSAR739231
FEATURES
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NAMES
    SMILES
    COc1ccc2c(OS(=O)(=O)c3ccc(C)cc3)c(NC(=O)c3ccc4c(c3)CCC(C)(C)O4)c(=O)oc2c1C
    InChI
    InChI=1S/C30H29NO8S/c1-17-6-9-21(10-7-17)40(34,35)39-27-22-11-13-23(36-5)18(2)26(22)37-29(33)25(27)31-28(32)20-8-12-24-19(16-20)14-15-30(3,4)38-24/h6-13,16H,14-15H2,1-5H3,(H,31,32)
    MOLECULAR FORMULA
    C30H29NO8S
    CROSS REFERENCES
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    canSAR739231
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight563.16
    AlogP5.54
    HBond donors1
    HBond acceptors9
    Atoms69
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR739231.