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canSAR1973531
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NAMES
    SMILES
    COc1cccc(C2CC(c3ccccc3)=NN2c2ccc(S(N)(=O)=O)cc2)c1
    InChI
    InChI=1S/C22H21N3O3S/c1-28-19-9-5-8-17(14-19)22-15-21(16-6-3-2-4-7-16)24-25(22)18-10-12-20(13-11-18)29(23,26)27/h2-14,22H,15H2,1H3,(H2,23,26,27)
    MOLECULAR FORMULA
    C22H21N3O3S
    CROSS REFERENCES
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    canSAR1973531

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 407.13
    AlogP 3.70
    HBond donors 2
    HBond acceptors 6
    Atoms 50
    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 canSAR1973531.