1951444 logo
canSAR1951444
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cc(NC(=O)c2ccc3c(c2)N(Cc2cccc(Cl)c2)C(=O)c2ccccc2S3(=O)=O)ccc1Br
    InChI
    InChI=1S/C28H20BrClN2O4S/c1-17-13-21(10-11-23(17)29)31-27(33)19-9-12-26-24(15-19)32(16-18-5-4-6-20(30)14-18)28(34)22-7-2-3-8-25(22)37(26,35)36/h2-15H,16H2,1H3,(H,31,33)
    MOLECULAR FORMULA
    C28H20BrClN2O4S
    CROSS REFERENCES
    1951444 logo

    canSAR1951444

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 594.00
    AlogP 6.66
    HBond donors 1
    HBond acceptors 6
    Atoms 57
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1951444.