canSAR1388099
FEATURES
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NAMES
    SMILES
    CCN(CC)[C@H]1CN(C(=O)c2ccc(C#N)cc2)[C@@H]2CCCO[C@@H]12.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C19H25N3O2.C2HF3O2/c1-3-21(4-2)17-13-22(16-6-5-11-24-18(16)17)19(23)15-9-7-14(12-20)8-10-15;3-2(4,5)1(6)7/h7-10,16-18H,3-6,11,13H2,1-2H3;(H,6,7)
    MOLECULAR FORMULA
    C21H26F3N3O4
    CROSS REFERENCES
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    canSAR1388099
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight441.19
    AlogP2.91
    HBond donors1
    HBond acceptors7
    Atoms57
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1388099.