161866 logo
canSAR161866
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccccc1Nc1ccc([N+](=O)[O-])cc1S(N)(=O)=O
    InChI
    InChI=1S/C13H13N3O4S/c1-9-4-2-3-5-11(9)15-12-7-6-10(16(17)18)8-13(12)21(14,19)20/h2-8,15H,1H3,(H2,14,19,20)
    MOLECULAR FORMULA
    C13H13N3O4S
    CROSS REFERENCES
    161866 logo

    canSAR161866

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 307.06
    AlogP 2.29
    HBond donors 3
    HBond acceptors 7
    Atoms 34
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR161866.