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canSAR4003
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NAMES
    SMILES
    CCC(=O)C1C2CC3CCC1N3C/C2=C\c1ccc(Cl)c(Cl)c1
    InChI
    InChI=1S/C19H21Cl2NO/c1-2-18(23)19-14-9-13-4-6-17(19)22(13)10-12(14)7-11-3-5-15(20)16(21)8-11/h3,5,7-8,13-14,17,19H,2,4,6,9-10H2,1H3/b12-7+
    MOLECULAR FORMULA
    C19H21Cl2NO
    CROSS REFERENCES
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    canSAR4003

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 349.10
    AlogP 4.84
    HBond donors 0
    HBond acceptors 2
    Atoms 44
    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 canSAR4003.