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canSAR989552
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NAMES
    SMILES
    COc1cc(Cl)ccc1C(=O)NC1C[C@H]2CC[C@H](C1)N2Cc1ccco1
    InChI
    InChI=1S/C20H23ClN2O3/c1-25-19-9-13(21)4-7-18(19)20(24)22-14-10-15-5-6-16(11-14)23(15)12-17-3-2-8-26-17/h2-4,7-9,14-16H,5-6,10-12H2,1H3,(H,22,24)/t15-,16-/m1/s1
    MOLECULAR FORMULA
    C20H23ClN2O3
    CROSS REFERENCES
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    canSAR989552

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 374.14
    AlogP 3.87
    HBond donors 1
    HBond acceptors 5
    Atoms 49
    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 canSAR989552.