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canSAR1266121
FEATURES
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NAMES
    SMILES
    CC(C)[C@H](CC(=O)[C@H]1Cc2ccc(F)cc2CN1)CN1CC[C@@](C)(c2cccc(F)c2)[C@@H](C)C1
    InChI
    InChI=1S/C29H38F2N2O/c1-19(2)23(14-28(34)27-13-21-8-9-26(31)12-22(21)16-32-27)18-33-11-10-29(4,20(3)17-33)24-6-5-7-25(30)15-24/h5-9,12,15,19-20,23,27,32H,10-11,13-14,16-18H2,1-4H3/t20-,23+,27+,29+/m0/s1
    MOLECULAR FORMULA
    C29H38F2N2O
    CROSS REFERENCES
    1266121 logo

    canSAR1266121

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.30
    AlogP 5.51
    HBond donors 1
    HBond acceptors 3
    Atoms 72
    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 canSAR1266121.