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canSAR1143201
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NAMES
    SMILES
    CCCCOC(=O)C1=C(Nc2ccc3ccccc3c2)SCC1=O
    InChI
    InChI=1S/C19H19NO3S/c1-2-3-10-23-19(22)17-16(21)12-24-18(17)20-15-9-8-13-6-4-5-7-14(13)11-15/h4-9,11,20H,2-3,10,12H2,1H3
    MOLECULAR FORMULA
    C19H19NO3S
    CROSS REFERENCES
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    canSAR1143201

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 341.11
    AlogP 4.12
    HBond donors 1
    HBond acceptors 4
    Atoms 43
    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 canSAR1143201.