1522535 logo
canSAR1522535
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(NS(=O)(=O)c2ccc(N/C=C(\C=O)c3nc4ccccc4o3)cc2)nc(OC)n1
    InChI
    InChI=1S/C22H19N5O6S/c1-31-20-11-19(25-22(26-20)32-2)27-34(29,30)16-9-7-15(8-10-16)23-12-14(13-28)21-24-17-5-3-4-6-18(17)33-21/h3-13,23H,1-2H3,(H,25,26,27)/b14-12+
    MOLECULAR FORMULA
    C22H19N5O6S
    CROSS REFERENCES
    1522535 logo

    canSAR1522535

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 481.11
    AlogP 3.09
    HBond donors 2
    HBond acceptors 11
    Atoms 53
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1522535.