canSAR1584478
FEATURES
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NAMES
    SMILES
    C=CC[n+]1c(-c2ccc(Cl)cc2Cl)csc1Nc1ccc(NC(C)=O)cc1.[Cl-]
    InChI
    InChI=1S/C20H17Cl2N3OS.ClH/c1-3-10-25-19(17-9-4-14(21)11-18(17)22)12-27-20(25)24-16-7-5-15(6-8-16)23-13(2)26;/h3-9,11-12H,1,10H2,2H3,(H,23,26);1H
    MOLECULAR FORMULA
    C20H18Cl3N3OS
    CROSS REFERENCES
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    canSAR1584478
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight453.02
    AlogP2.90
    HBond donors2
    HBond acceptors4
    Atoms46
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1584478.