1591522 logo
canSAR1591522
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(/C=C/c1ccc(S(=O)(=O)NCc2ccco2)cc1)NCc1cccc(Cl)c1
    InChI
    InChI=1S/C21H19ClN2O4S/c22-18-4-1-3-17(13-18)14-23-21(25)11-8-16-6-9-20(10-7-16)29(26,27)24-15-19-5-2-12-28-19/h1-13,24H,14-15H2,(H,23,25)/b11-8+
    MOLECULAR FORMULA
    C21H19ClN2O4S
    CROSS REFERENCES
    1591522 logo

    canSAR1591522

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 430.08
    AlogP 3.74
    HBond donors 2
    HBond acceptors 6
    Atoms 48
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1591522.