669683 logo
canSAR669683
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C1/C(=C/c2ccc(O)c(Cl)c2)S/C(=N\C2CCCC2)N1c1ccccc1
    InChI
    InChI=1S/C21H19ClN2O2S/c22-17-12-14(10-11-18(17)25)13-19-20(26)24(16-8-2-1-3-9-16)21(27-19)23-15-6-4-5-7-15/h1-3,8-13,15,25H,4-7H2/b19-13-,23-21-
    MOLECULAR FORMULA
    C21H19ClN2O2S
    CROSS REFERENCES
    669683 logo

    canSAR669683

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.09
    AlogP 5.47
    HBond donors 1
    HBond acceptors 4
    Atoms 46
    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 canSAR669683.