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canSAR1145515
FEATURES
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NAMES
    SMILES
    Cc1cccc2c3c(n(CC(=O)O)c12)CCN(C(=O)c1ccccc1)C3
    InChI
    InChI=1S/C21H20N2O3/c1-14-6-5-9-16-17-12-22(21(26)15-7-3-2-4-8-15)11-10-18(17)23(20(14)16)13-19(24)25/h2-9H,10-13H2,1H3,(H,24,25)
    MOLECULAR FORMULA
    C21H20N2O3
    CROSS REFERENCES
    1145515 logo

    canSAR1145515

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.15
    AlogP 3.23
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1145515.