1514316 logo
canSAR1514316
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cccc(/C=C2\CS/C(=C\c3cccc(C)c3)C2=O)c1
    InChI
    InChI=1S/C20H18OS/c1-14-5-3-7-16(9-14)11-18-13-22-19(20(18)21)12-17-8-4-6-15(2)10-17/h3-12H,13H2,1-2H3/b18-11+,19-12-
    MOLECULAR FORMULA
    C20H18OS
    CROSS REFERENCES
    1514316 logo

    canSAR1514316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 306.11
    AlogP 5.04
    HBond donors 0
    HBond acceptors 1
    Atoms 40
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1514316.