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canSAR1686129
FEATURES
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NAMES
    SMILES
    CC1(C)C[C@@H](NC(=O)Nc2ccc3c(c2)NC(=O)CC3)c2cccc(C(F)(F)F)c2O1
    InChI
    InChI=1S/C22H22F3N3O3/c1-21(2)11-17(14-4-3-5-15(19(14)31-21)22(23,24)25)28-20(30)26-13-8-6-12-7-9-18(29)27-16(12)10-13/h3-6,8,10,17H,7,9,11H2,1-2H3,(H,27,29)(H2,26,28,30)/t17-/m1/s1
    MOLECULAR FORMULA
    C22H22F3N3O3
    CROSS REFERENCES
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    canSAR1686129

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 433.16
    AlogP 5.01
    HBond donors 3
    HBond acceptors 6
    Atoms 53
    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 canSAR1686129.