canSAR216470
FEATURES
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NAMES
    SMILES
    Cc1c(CCS(=O)(=O)c2ccc(CCC(=O)O)cc2)c2cc(Cl)ccc2n1C(c1ccccc1)c1ccccc1
    InChI
    InChI=1S/C33H30ClNO4S/c1-23-29(20-21-40(38,39)28-16-12-24(13-17-28)14-19-32(36)37)30-22-27(34)15-18-31(30)35(23)33(25-8-4-2-5-9-25)26-10-6-3-7-11-26/h2-13,15-18,22,33H,14,19-21H2,1H3,(H,36,37)
    MOLECULAR FORMULA
    C33H30ClNO4S
    CROSS REFERENCES
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    canSAR216470
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight571.16
    AlogP7.27
    HBond donors1
    HBond acceptors5
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR216470.