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canSAR1269651
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NAMES
    SMILES
    COc1cc(/C(C#N)=C/c2nc3ccccc3s2)cc(OC)c1OC
    InChI
    InChI=1S/C19H16N2O3S/c1-22-15-8-12(9-16(23-2)19(15)24-3)13(11-20)10-18-21-14-6-4-5-7-17(14)25-18/h4-10H,1-3H3/b13-10+
    MOLECULAR FORMULA
    C19H16N2O3S
    CROSS REFERENCES
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    canSAR1269651

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 352.09
    AlogP 4.39
    HBond donors 0
    HBond acceptors 5
    Atoms 41
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1269651.