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canSAR102244
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H]1C(=O)N[C@H](C(=O)NCC(F)(F)F)Cc2ccc(cc2)OCCC[C@@H]1C(=O)NO
    InChI
    InChI=1S/C22H30F3N3O5/c1-13(2)10-17-16(20(30)28-32)4-3-9-33-15-7-5-14(6-8-15)11-18(27-19(17)29)21(31)26-12-22(23,24)25/h5-8,13,16-18,32H,3-4,9-12H2,1-2H3,(H,26,31)(H,27,29)(H,28,30)/t16-,17+,18-/m0/s1
    MOLECULAR FORMULA
    C22H30F3N3O5
    CROSS REFERENCES
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    canSAR102244

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 473.21
    AlogP 2.35
    HBond donors 4
    HBond acceptors 8
    Atoms 63
    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 canSAR102244.