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canSAR2208561
FEATURES
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NAMES
    SMILES
    CC[C@@H](NC(=O)c1cc(C(=O)N[C@H](C)c2ccc(F)cc2)c2n1CCS2)c1ccccc1
    InChI
    InChI=1S/C25H26FN3O2S/c1-3-21(18-7-5-4-6-8-18)28-24(31)22-15-20(25-29(22)13-14-32-25)23(30)27-16(2)17-9-11-19(26)12-10-17/h4-12,15-16,21H,3,13-14H2,1-2H3,(H,27,30)(H,28,31)/t16-,21-/m1/s1
    MOLECULAR FORMULA
    C25H26FN3O2S
    CROSS REFERENCES
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    canSAR2208561

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.17
    AlogP 5.11
    HBond donors 2
    HBond acceptors 5
    Atoms 58
    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 canSAR2208561.