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canSAR1634880
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NAMES
    SMILES
    COc1ccc(CNC(=O)c2noc(C(C)C)c2[N+](=O)[O-])cc1
    InChI
    InChI=1S/C15H17N3O5/c1-9(2)14-13(18(20)21)12(17-23-14)15(19)16-8-10-4-6-11(22-3)7-5-10/h4-7,9H,8H2,1-3H3,(H,16,19)
    MOLECULAR FORMULA
    C15H17N3O5
    CROSS REFERENCES
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    canSAR1634880

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 319.12
    AlogP 2.64
    HBond donors 1
    HBond acceptors 8
    Atoms 40
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1634880.