1268967 logo
canSAR1268967
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccc(SC2=C(O)CC(c3ccccc3)CC2=O)cc1C
    InChI
    InChI=1S/C20H20O2S/c1-13-8-9-17(10-14(13)2)23-20-18(21)11-16(12-19(20)22)15-6-4-3-5-7-15/h3-10,16,21H,11-12H2,1-2H3
    MOLECULAR FORMULA
    C20H20O2S
    CROSS REFERENCES
    1268967 logo

    canSAR1268967

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 324.12
    AlogP 5.31
    HBond donors 1
    HBond acceptors 2
    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 canSAR1268967.