2018774 logo
canSAR2018774
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=c1cc[c-](C[NH+]=Nc2ccc([N+](=O)[O-])cn2)c(O)c1
    InChI
    InChI=1S/C12H9N4O4/c17-10-3-1-8(11(18)5-10)6-14-15-12-4-2-9(7-13-12)16(19)20/h1-5,7,18H,6H2/q-1/p+1
    MOLECULAR FORMULA
    C12H10N4O4
    CROSS REFERENCES
    2018774 logo

    canSAR2018774

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 274.07
    AlogP 0.14
    HBond donors 2
    HBond acceptors 8
    Atoms 30
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2018774.