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canSAR913591
FEATURES
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NAMES
    SMILES
    O=C(N[C@H]1CCO[C@@H](c2cccc([N+](=O)[O-])c2)OC1)c1ccccc1
    InChI
    InChI=1S/C18H18N2O5/c21-17(13-5-2-1-3-6-13)19-15-9-10-24-18(25-12-15)14-7-4-8-16(11-14)20(22)23/h1-8,11,15,18H,9-10,12H2,(H,19,21)/t15-,18+/m0/s1
    MOLECULAR FORMULA
    C18H18N2O5
    CROSS REFERENCES
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    canSAR913591

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.12
    AlogP 2.83
    HBond donors 1
    HBond acceptors 7
    Atoms 43
    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 canSAR913591.