1529954 logo
canSAR1529954
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC1=NC(=O)N[C@@H](c2ccc([N+](=O)[O-])cc2)C1C(=O)OC1CCCC1
    InChI
    InChI=1S/C17H19N3O5/c1-10-14(16(21)25-13-4-2-3-5-13)15(19-17(22)18-10)11-6-8-12(9-7-11)20(23)24/h6-9,13-15H,2-5H2,1H3,(H,19,22)/t14?,15-/m0/s1
    MOLECULAR FORMULA
    C17H19N3O5
    CROSS REFERENCES
    1529954 logo

    canSAR1529954

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 345.13
    AlogP 2.92
    HBond donors 1
    HBond acceptors 8
    Atoms 44
    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 canSAR1529954.