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canSAR1401830
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NAMES
    SMILES
    CN1CC[C@]23Cc4nc5ccc(Cl)cc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc13
    InChI
    InChI=1S/C24H23ClN2O2/c1-27-7-6-23-13-21-16(8-15-9-17(25)3-5-20(15)26-21)12-24(23,29)22(27)10-14-2-4-18(28)11-19(14)23/h2-5,8-9,11,22,28-29H,6-7,10,12-13H2,1H3/t22-,23-,24-/m1/s1
    MOLECULAR FORMULA
    C24H23ClN2O2
    CROSS REFERENCES
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    canSAR1401830

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 406.14
    AlogP 3.62
    HBond donors 2
    HBond acceptors 4
    Atoms 52
    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 canSAR1401830.