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canSAR35346
FEATURES
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NAMES
    SMILES
    CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(F)(F)CCc1ccccc1
    InChI
    InChI=1S/C31H34F2N2O4/c1-22(2)27(35-30(38)39-21-25-16-10-5-11-17-25)29(37)34-26(20-24-14-8-4-9-15-24)28(36)31(32,33)19-18-23-12-6-3-7-13-23/h3-17,22,26-27H,18-21H2,1-2H3,(H,34,37)(H,35,38)/t26-,27-/m0/s1
    MOLECULAR FORMULA
    C31H34F2N2O4
    CROSS REFERENCES
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    canSAR35346

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 536.25
    AlogP 5.50
    HBond donors 2
    HBond acceptors 6
    Atoms 73
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR35346.