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canSAR172326
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NAMES
    SMILES
    CN1CC[C@@H](c2ccc(Cl)cc2)[C@H](c2nc(-c3ccc4c(c3)OCO4)no2)C1
    InChI
    InChI=1S/C21H20ClN3O3/c1-25-9-8-16(13-2-5-15(22)6-3-13)17(11-25)21-23-20(24-28-21)14-4-7-18-19(10-14)27-12-26-18/h2-7,10,16-17H,8-9,11-12H2,1H3/t16-,17+/m0/s1
    MOLECULAR FORMULA
    C21H20ClN3O3
    CROSS REFERENCES
    172326 logo

    canSAR172326

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.12
    AlogP 4.32
    HBond donors 0
    HBond acceptors 6
    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 canSAR172326.