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canSAR1063934
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NAMES
    SMILES
    Cc1ncsc1C(OC(=O)C1(CO[N+](=O)[O-])CC1)c1ccccc1
    InChI
    InChI=1S/C16H16N2O5S/c1-11-14(24-10-17-11)13(12-5-3-2-4-6-12)23-15(19)16(7-8-16)9-22-18(20)21/h2-6,10,13H,7-9H2,1H3
    MOLECULAR FORMULA
    C16H16N2O5S
    CROSS REFERENCES
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    canSAR1063934

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.08
    AlogP 3.07
    HBond donors 0
    HBond acceptors 7
    Atoms 40
    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 canSAR1063934.