canSAR1746167
FEATURES
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NAMES
    SMILES
    Cc1cc(CNC(=O)[C@H](CC2CCCCC2)Nc2ccc(C#N)c3ccccc23)c(C(F)(F)F)o1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C27H28F3N3O2.C2HF3O2/c1-17-13-20(25(35-17)27(28,29)30)16-32-26(34)24(14-18-7-3-2-4-8-18)33-23-12-11-19(15-31)21-9-5-6-10-22(21)23;3-2(4,5)1(6)7/h5-6,9-13,18,24,33H,2-4,7-8,14,16H2,1H3,(H,32,34);(H,6,7)
    MOLECULAR FORMULA
    C29H29F6N3O4
    CROSS REFERENCES
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    canSAR1746167
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight597.21
    AlogP7.33
    HBond donors3
    HBond acceptors7
    Atoms71
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746167.