74450 logo
canSAR74450
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CN1CCC(CNS(=O)(=O)c2cc(Cl)cc(Cl)c2)(c2ccc(-c3cccc(C#N)c3)cc2)CC1
    InChI
    InChI=1S/C26H25Cl2N3O2S/c1-31-11-9-26(10-12-31,18-30-34(32,33)25-15-23(27)14-24(28)16-25)22-7-5-20(6-8-22)21-4-2-3-19(13-21)17-29/h2-8,13-16,30H,9-12,18H2,1H3
    MOLECULAR FORMULA
    C26H25Cl2N3O2S
    CROSS REFERENCES
    74450 logo

    canSAR74450

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 513.10
    AlogP 5.47
    HBond donors 1
    HBond acceptors 5
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR74450.