1087681 logo
canSAR1087681
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    OCc1c(CO)c(-c2ccccc2)n2c1CS[C@@H]2c1ccccc1
    InChI
    InChI=1S/C20H19NO2S/c22-11-16-17(12-23)19(14-7-3-1-4-8-14)21-18(16)13-24-20(21)15-9-5-2-6-10-15/h1-10,20,22-23H,11-13H2/t20-/m1/s1
    MOLECULAR FORMULA
    C20H19NO2S
    CROSS REFERENCES
    1087681 logo

    canSAR1087681

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 337.11
    AlogP 3.93
    HBond donors 2
    HBond acceptors 3
    Atoms 43
    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 canSAR1087681.