2281854 logo
canSAR2281854
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cc(-c2sc3cc(O)ccc3c2Oc2ccc(/C=C/C(=O)O)cc2)ccc1O
    InChI
    InChI=1S/C24H18O5S/c1-14-12-16(5-10-20(14)26)24-23(19-9-6-17(25)13-21(19)30-24)29-18-7-2-15(3-8-18)4-11-22(27)28/h2-13,25-26H,1H3,(H,27,28)/b11-4+
    MOLECULAR FORMULA
    C24H18O5S
    CROSS REFERENCES
    2281854 logo

    canSAR2281854

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.09
    AlogP 6.18
    HBond donors 3
    HBond acceptors 5
    Atoms 48
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2281854.