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canSAR1445931
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NAMES
    SMILES
    Cc1cc(SC2C(=O)CC(CCc3ncsc3C)(C(C)C)OC2=O)c(C(C)(C)C)cc1CO
    InChI
    InChI=1S/C26H35NO4S2/c1-15(2)26(9-8-20-17(4)32-14-27-20)12-21(29)23(24(30)31-26)33-22-10-16(3)18(13-28)11-19(22)25(5,6)7/h10-11,14-15,23,28H,8-9,12-13H2,1-7H3
    MOLECULAR FORMULA
    C26H35NO4S2
    CROSS REFERENCES
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    canSAR1445931

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 489.20
    AlogP 5.55
    HBond donors 1
    HBond acceptors 5
    Atoms 68
    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 canSAR1445931.