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canSAR1961251
FEATURES
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NAMES
    SMILES
    O=C1N=C(O)C(=Cc2ccc(OCCC3CCCCC3)cc2Cl)S1
    InChI
    InChI=1S/C18H20ClNO3S/c19-15-11-14(23-9-8-12-4-2-1-3-5-12)7-6-13(15)10-16-17(21)20-18(22)24-16/h6-7,10-12H,1-5,8-9H2,(H,20,21,22)
    MOLECULAR FORMULA
    C18H20ClNO3S
    CROSS REFERENCES
    1961251 logo

    canSAR1961251

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 365.09
    AlogP 5.85
    HBond donors 1
    HBond acceptors 4
    Atoms 44
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1961251.