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canSAR162007
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NAMES
    SMILES
    CN1C2CCC1[C@@H](C(=O)OCCc1ccccc1)[C@@H](c1ccc(Cl)c(Cl)c1)C2
    InChI
    InChI=1S/C23H25Cl2NO2/c1-26-17-8-10-21(26)22(18(14-17)16-7-9-19(24)20(25)13-16)23(27)28-12-11-15-5-3-2-4-6-15/h2-7,9,13,17-18,21-22H,8,10-12,14H2,1H3/t17?,18-,21?,22+/m1/s1
    MOLECULAR FORMULA
    C23H25Cl2NO2
    CROSS REFERENCES
    162007 logo

    canSAR162007

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 417.13
    AlogP 5.35
    HBond donors 0
    HBond acceptors 3
    Atoms 53
    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 canSAR162007.