789737 logo
canSAR789737
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)Cc1ccc(C(C)C(=O)C[N+](=O)[O-])cc1
    InChI
    InChI=1S/C14H19NO3/c1-10(2)8-12-4-6-13(7-5-12)11(3)14(16)9-15(17)18/h4-7,10-11H,8-9H2,1-3H3
    MOLECULAR FORMULA
    C14H19NO3
    CROSS REFERENCES
    789737 logo

    canSAR789737

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 249.14
    AlogP 2.83
    HBond donors 0
    HBond acceptors 4
    Atoms 37
    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 canSAR789737.