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canSAR1018610
FEATURES
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NAMES
    SMILES
    C[C@@](O)(c1ccc(C(=O)N(C2CC2)[C@H]2CC[C@H](CC#N)CC2)cc1)C(F)(F)F
    InChI
    InChI=1S/C21H25F3N2O2/c1-20(28,21(22,23)24)16-6-4-15(5-7-16)19(27)26(18-10-11-18)17-8-2-14(3-9-17)12-13-25/h4-7,14,17-18,28H,2-3,8-12H2,1H3/t14-,17-,20-/m1/s1
    MOLECULAR FORMULA
    C21H25F3N2O2
    CROSS REFERENCES
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    canSAR1018610

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 394.19
    AlogP 4.53
    HBond donors 1
    HBond acceptors 4
    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 canSAR1018610.