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canSAR552688
FEATURES
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NAMES
    SMILES
    C[S+](C)CCC(=O)Nc1ccc(CC(=O)O)cc1
    InChI
    InChI=1S/C13H17NO3S/c1-18(2)8-7-12(15)14-11-5-3-10(4-6-11)9-13(16)17/h3-6H,7-9H2,1-2H3,(H-,14,15,16,17)/p+1
    MOLECULAR FORMULA
    C13H18NO3S+
    CROSS REFERENCES
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    canSAR552688

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 268.10
    AlogP 1.52
    HBond donors 2
    HBond acceptors 4
    Atoms 36
    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 canSAR552688.