canSAR1810338
FEATURES
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NAMES
    SMILES
    COc1cc(NC(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)cc(OC)c1OC
    InChI
    InChI=1S/C18H23N3O6S/c1-25-13-6-10(7-14(26-2)16(13)27-3)19-17(23)12-8-28-9-21(12)18(24)11-4-5-15(22)20-11/h6-7,11-12H,4-5,8-9H2,1-3H3,(H,19,23)(H,20,22)/t11-,12+/m0/s1
    MOLECULAR FORMULA
    C18H23N3O6S
    CROSS REFERENCES
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    canSAR1810338
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight409.13
    AlogP0.83
    HBond donors2
    HBond acceptors9
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1810338.