canSAR1746409
FEATURES
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NAMES
    SMILES
    C[C@H]1CN([C@H](C)CO)S(=O)(=O)c2ccc(C3=CCCC3)cc2O[C@H]1CN(C)Cc1ccccc1F
    InChI
    InChI=1S/C27H35FN2O4S/c1-19-15-30(20(2)18-31)35(32,33)27-13-12-22(21-8-4-5-9-21)14-25(27)34-26(19)17-29(3)16-23-10-6-7-11-24(23)28/h6-8,10-14,19-20,26,31H,4-5,9,15-18H2,1-3H3/t19-,20+,26-/m0/s1
    MOLECULAR FORMULA
    C27H35FN2O4S
    CROSS REFERENCES
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    canSAR1746409
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight502.23
    AlogP4.29
    HBond donors1
    HBond acceptors6
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746409.