canSAR1417150
FEATURES
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NAMES
    SMILES
    C[C@@H]1O[C@H](C)CN2c3c(cc4c(C(=O)N5CC(F)(F)C5)noc4c3F)CC3(C(=O)NC(=O)NC3=O)[C@@H]12
    InChI
    InChI=1S/C22H20F3N5O6/c1-8-5-30-14-10(4-22(16(30)9(2)35-8)18(32)26-20(34)27-19(22)33)3-11-13(28-36-15(11)12(14)23)17(31)29-6-21(24,25)7-29/h3,8-9,16H,4-7H2,1-2H3,(H2,26,27,32,33,34)/t8-,9+,16-/m1/s1
    MOLECULAR FORMULA
    C22H20F3N5O6
    CROSS REFERENCES
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    canSAR1417150
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight507.14
    AlogP0.95
    HBond donors2
    HBond acceptors11
    Atoms56
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417150.