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canSAR1203364
FEATURES
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NAMES
    SMILES
    CCC(CC)C(=O)OC1N=C(c2ccccc2)c2cc(Cl)ccc2N[14C]1=O
    InChI
    InChI=1S/C21H21ClN2O3/c1-3-13(4-2)21(26)27-20-19(25)23-17-11-10-15(22)12-16(17)18(24-20)14-8-6-5-7-9-14/h5-13,20H,3-4H2,1-2H3,(H,23,25)/i19+2
    MOLECULAR FORMULA
    C21H21ClN2O3
    CROSS REFERENCES
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    canSAR1203364

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.13
    AlogP 4.43
    HBond donors 1
    HBond acceptors 5
    Atoms 48
    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 canSAR1203364.