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canSAR986219
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NAMES
    SMILES
    Cc1cc([C@H](c2ccccc2)C(C)(C)C(=O)Nc2nncs2)ccc1O
    InChI
    InChI=1S/C20H21N3O2S/c1-13-11-15(9-10-16(13)24)17(14-7-5-4-6-8-14)20(2,3)18(25)22-19-23-21-12-26-19/h4-12,17,24H,1-3H3,(H,22,23,25)/t17-/m0/s1
    MOLECULAR FORMULA
    C20H21N3O2S
    CROSS REFERENCES
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    canSAR986219

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 367.14
    AlogP 4.35
    HBond donors 2
    HBond acceptors 5
    Atoms 47
    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 canSAR986219.