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canSAR674980
FEATURES
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NAMES
    SMILES
    CC(C)N(C)[C@@H]1CC[C@H](NC(=O)CNC(=O)c2cccc(C(F)(F)F)c2)[C@H](CS(=O)(=O)c2ccccc2)C1
    InChI
    InChI=1S/C27H34F3N3O4S/c1-18(2)33(3)22-12-13-24(20(15-22)17-38(36,37)23-10-5-4-6-11-23)32-25(34)16-31-26(35)19-8-7-9-21(14-19)27(28,29)30/h4-11,14,18,20,22,24H,12-13,15-17H2,1-3H3,(H,31,35)(H,32,34)/t20-,22+,24-/m0/s1
    MOLECULAR FORMULA
    C27H34F3N3O4S
    CROSS REFERENCES
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    canSAR674980

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 553.22
    AlogP 3.90
    HBond donors 2
    HBond acceptors 7
    Atoms 72
    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 canSAR674980.