1147111 logo
canSAR1147111
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1c(/C=N/N2CCN(C)CC2)c2ccccc2n1S(=O)(=O)c1ccc(F)cc1
    InChI
    InChI=1S/C21H23FN4O2S/c1-16-20(15-23-25-13-11-24(2)12-14-25)19-5-3-4-6-21(19)26(16)29(27,28)18-9-7-17(22)8-10-18/h3-10,15H,11-14H2,1-2H3/b23-15+
    MOLECULAR FORMULA
    C21H23FN4O2S
    CROSS REFERENCES
    1147111 logo

    canSAR1147111

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 414.15
    AlogP 2.91
    HBond donors 0
    HBond acceptors 6
    Atoms 52
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1147111.