1969338 logo
canSAR1969338
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOc1ccc(CCNC(=O)c2ccc3c(c2)N(Cc2ccc(F)cc2)CCS3)cc1
    InChI
    InChI=1S/C26H27FN2O2S/c1-2-31-23-10-5-19(6-11-23)13-14-28-26(30)21-7-12-25-24(17-21)29(15-16-32-25)18-20-3-8-22(27)9-4-20/h3-12,17H,2,13-16,18H2,1H3,(H,28,30)
    MOLECULAR FORMULA
    C26H27FN2O2S
    CROSS REFERENCES
    1969338 logo

    canSAR1969338

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.18
    AlogP 5.31
    HBond donors 1
    HBond acceptors 4
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1969338.