1998086 logo
canSAR1998086
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC3(CC2)OCCN3S(=O)(=O)c2cccs2)cc1
    InChI
    InChI=1S/C17H19N3O7S3/c21-20(22)14-3-5-15(6-4-14)29(23,24)18-9-7-17(8-10-18)19(11-12-27-17)30(25,26)16-2-1-13-28-16/h1-6,13H,7-12H2
    MOLECULAR FORMULA
    C17H19N3O7S3
    CROSS REFERENCES
    1998086 logo

    canSAR1998086

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 473.04
    AlogP 1.86
    HBond donors 0
    HBond acceptors 10
    Atoms 49
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1998086.