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canSAR1974722
FEATURES
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NAMES
    SMILES
    CCCC#Cc1ccc([C@@H]2[C@H]3CN(S(=O)(=O)c4ccccc4F)CCCCN3[C@H]2CO)cc1
    InChI
    InChI=1S/C26H31FN2O3S/c1-2-3-4-9-20-12-14-21(15-13-20)26-23-18-28(16-7-8-17-29(23)24(26)19-30)33(31,32)25-11-6-5-10-22(25)27/h5-6,10-15,23-24,26,30H,2-3,7-8,16-19H2,1H3/t23-,24+,26-/m1/s1
    MOLECULAR FORMULA
    C26H31FN2O3S
    CROSS REFERENCES
    1974722 logo

    canSAR1974722

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.20
    AlogP 3.59
    HBond donors 1
    HBond acceptors 5
    Atoms 64
    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 canSAR1974722.