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canSAR560332
FEATURES
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NAMES
    SMILES
    O=C(O)CCNCc1cc([N+](=O)[O-])cc2nc(O)c(O)nc12
    InChI
    InChI=1S/C12H12N4O6/c17-9(18)1-2-13-5-6-3-7(16(21)22)4-8-10(6)15-12(20)11(19)14-8/h3-4,13H,1-2,5H2,(H,14,19)(H,15,20)(H,17,18)
    MOLECULAR FORMULA
    C12H12N4O6
    CROSS REFERENCES
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    canSAR560332

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 308.08
    AlogP 0.51
    HBond donors 4
    HBond acceptors 10
    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 canSAR560332.