1685892 logo
canSAR1685892
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOC(=O)c1ccc(NC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)cc1
    InChI
    InChI=1S/C22H25N3O6S/c1-3-31-22(28)17-7-9-19(10-8-17)23-21(27)18-5-4-6-20(15-18)32(29,30)25-13-11-24(12-14-25)16(2)26/h4-10,15H,3,11-14H2,1-2H3,(H,23,27)
    MOLECULAR FORMULA
    C22H25N3O6S
    CROSS REFERENCES
    1685892 logo

    canSAR1685892

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 459.15
    AlogP 1.97
    HBond donors 1
    HBond acceptors 9
    Atoms 57
    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 canSAR1685892.