727295 logo
canSAR727295
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCc1ccc(CSc2oc3ccccc3c(=O)c2C)cc1
    InChI
    InChI=1S/C21H22O2S/c1-3-4-7-16-10-12-17(13-11-16)14-24-21-15(2)20(22)18-8-5-6-9-19(18)23-21/h5-6,8-13H,3-4,7,14H2,1-2H3
    MOLECULAR FORMULA
    C21H22O2S
    CROSS REFERENCES
    727295 logo

    canSAR727295

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 338.13
    AlogP 5.74
    HBond donors 0
    HBond acceptors 2
    Atoms 46
    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 canSAR727295.