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canSAR919826
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1cn(CCC(O)c2ccccc2)cn1
    InChI
    InChI=1S/C12H13N3O3/c16-11(10-4-2-1-3-5-10)6-7-14-8-12(13-9-14)15(17)18/h1-5,8-9,11,16H,6-7H2
    MOLECULAR FORMULA
    C12H13N3O3
    CROSS REFERENCES
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    canSAR919826

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 247.10
    AlogP 1.92
    HBond donors 1
    HBond acceptors 6
    Atoms 31
    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 canSAR919826.