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canSAR991938
FEATURES
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NAMES
    SMILES
    Cc1cc(O)c(=O)c(O)c2c1C[C@@H](C(C)(O)CSCc1ccccc1)CC2
    InChI
    InChI=1S/C22H26O4S/c1-14-10-19(23)21(25)20(24)17-9-8-16(11-18(14)17)22(2,26)13-27-12-15-6-4-3-5-7-15/h3-7,10,16,26H,8-9,11-13H2,1-2H3,(H2,23,24,25)/t16-,22?/m0/s1
    MOLECULAR FORMULA
    C22H26O4S
    CROSS REFERENCES
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    canSAR991938

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.16
    AlogP 3.56
    HBond donors 3
    HBond acceptors 4
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR991938.