921852 logo
canSAR921852
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)C(CSSCC(NCCC(=O)c1ncc(C)s1)C(=O)OC)NCCC(=O)c1ncc(C)s1
    InChI
    InChI=1S/C22H30N4O6S4/c1-13-9-25-19(35-13)17(27)5-7-23-15(21(29)31-3)11-33-34-12-16(22(30)32-4)24-8-6-18(28)20-26-10-14(2)36-20/h9-10,15-16,23-24H,5-8,11-12H2,1-4H3
    MOLECULAR FORMULA
    C22H30N4O6S4
    CROSS REFERENCES
    921852 logo

    canSAR921852

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 574.10
    AlogP 2.71
    HBond donors 2
    HBond acceptors 10
    Atoms 66
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR921852.