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canSAR1618104
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NAMES
    SMILES
    Cc1cc(OCC(=O)Nc2ccccn2)c2c(C)cc(=O)oc2c1
    InChI
    InChI=1S/C18H16N2O4/c1-11-7-13(18-12(2)9-17(22)24-14(18)8-11)23-10-16(21)20-15-5-3-4-6-19-15/h3-9H,10H2,1-2H3,(H,19,20,21)
    MOLECULAR FORMULA
    C18H16N2O4
    CROSS REFERENCES
    1618104 logo

    canSAR1618104

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 324.11
    AlogP 2.82
    HBond donors 1
    HBond acceptors 6
    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 canSAR1618104.