1991226 logo
canSAR1991226
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1c(NC(=O)/C(O)=C/C(=O)c2ccc(Cl)cc2)c(=O)n(-c2ccccc2)n1C
    InChI
    InChI=1S/C21H18ClN3O4/c1-13-19(21(29)25(24(13)2)16-6-4-3-5-7-16)23-20(28)18(27)12-17(26)14-8-10-15(22)11-9-14/h3-12,27H,1-2H3,(H,23,28)/b18-12-
    MOLECULAR FORMULA
    C21H18ClN3O4
    CROSS REFERENCES
    1991226 logo

    canSAR1991226

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.10
    AlogP 3.40
    HBond donors 2
    HBond acceptors 7
    Atoms 47
    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 canSAR1991226.