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canSAR829627
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NAMES
    SMILES
    CS(=O)(=O)N1CCC(CN(C(=O)Nc2cccc(F)c2)C2CC[C@]3(c4cccc(C#N)c4)CC3C2)CC1
    InChI
    InChI=1S/C28H33FN4O3S/c1-37(35,36)32-12-9-20(10-13-32)19-33(27(34)31-25-7-3-6-24(29)16-25)26-8-11-28(17-23(28)15-26)22-5-2-4-21(14-22)18-30/h2-7,14,16,20,23,26H,8-13,15,17,19H2,1H3,(H,31,34)/t23?,26?,28-/m1/s1
    MOLECULAR FORMULA
    C28H33FN4O3S
    CROSS REFERENCES
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    canSAR829627

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 524.23
    AlogP 4.71
    HBond donors 1
    HBond acceptors 7
    Atoms 70
    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 canSAR829627.