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canSAR647008
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NAMES
    SMILES
    CC(=O)c1ccc(NC(=O)CSc2[se]nnc2-c2ccc(Cl)c(Cl)c2)c(Br)c1
    InChI
    InChI=1S/C18H12BrCl2N3O2SSe/c1-9(25)10-3-5-15(12(19)6-10)22-16(26)8-27-18-17(23-24-28-18)11-2-4-13(20)14(21)7-11/h2-7H,8H2,1H3,(H,22,26)
    MOLECULAR FORMULA
    C18H12BrCl2N3O2SSe
    CROSS REFERENCES
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    canSAR647008

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 562.84
    AlogP 5.20
    HBond donors 1
    HBond acceptors 5
    Atoms 40
    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 canSAR647008.