1964927 logo
canSAR1964927
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cn1c(SCc2ccc(C(C)(C)C)cc2)nnc1C1COc2ccccc2O1
    InChI
    InChI=1S/C22H25N3O2S/c1-22(2,3)16-11-9-15(10-12-16)14-28-21-24-23-20(25(21)4)19-13-26-17-7-5-6-8-18(17)27-19/h5-12,19H,13-14H2,1-4H3
    MOLECULAR FORMULA
    C22H25N3O2S
    CROSS REFERENCES
    1964927 logo

    canSAR1964927

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 395.17
    AlogP 4.92
    HBond donors 0
    HBond acceptors 5
    Atoms 53
    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 canSAR1964927.