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canSAR34858
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NAMES
    SMILES
    COC1=C(Sc2ccc(OC)cc2)C(=O)c2[se]c(C)nc2C1=O
    InChI
    InChI=1S/C16H13NO4SSe/c1-8-17-11-12(18)14(21-3)15(13(19)16(11)23-8)22-10-6-4-9(20-2)5-7-10/h4-7H,1-3H3
    MOLECULAR FORMULA
    C16H13NO4SSe
    CROSS REFERENCES
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    canSAR34858

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 394.97
    AlogP 2.48
    HBond donors 0
    HBond acceptors 5
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR34858.