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canSAR1595285
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NAMES
    SMILES
    COC(=O)[C@@H]1CCCN1C(=O)c1cnn(-c2nccc(-c3cc(C)sc3C)n2)c1C1CC1
    InChI
    InChI=1S/C23H25N5O3S/c1-13-11-16(14(2)32-13)18-8-9-24-23(26-18)28-20(15-6-7-15)17(12-25-28)21(29)27-10-4-5-19(27)22(30)31-3/h8-9,11-12,15,19H,4-7,10H2,1-3H3/t19-/m0/s1
    MOLECULAR FORMULA
    C23H25N5O3S
    CROSS REFERENCES
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    canSAR1595285

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.17
    AlogP 3.66
    HBond donors 0
    HBond acceptors 8
    Atoms 57
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1595285.