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canSAR1126384
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NAMES
    SMILES
    O=C(CSCCO)Nc1ccc2c(c1)C(=O)c1cc(NC(=O)CSCCO)ccc1-2
    InChI
    InChI=1S/C21H22N2O5S2/c24-5-7-29-11-19(26)22-13-1-3-15-16-4-2-14(23-20(27)12-30-8-6-25)10-18(16)21(28)17(15)9-13/h1-4,9-10,24-25H,5-8,11-12H2,(H,22,26)(H,23,27)
    MOLECULAR FORMULA
    C21H22N2O5S2
    CROSS REFERENCES
    1126384 logo

    canSAR1126384

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.10
    AlogP 2.23
    HBond donors 4
    HBond acceptors 7
    Atoms 52
    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 canSAR1126384.