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canSAR1528342
FEATURES
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NAMES
    SMILES
    COc1ccc(CCNC(=O)CSc2ccc(-c3cccs3)nn2)cc1OC
    InChI
    InChI=1S/C20H21N3O3S2/c1-25-16-7-5-14(12-17(16)26-2)9-10-21-19(24)13-28-20-8-6-15(22-23-20)18-4-3-11-27-18/h3-8,11-12H,9-10,13H2,1-2H3,(H,21,24)
    MOLECULAR FORMULA
    C20H21N3O3S2
    CROSS REFERENCES
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    canSAR1528342

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.10
    AlogP 3.67
    HBond donors 1
    HBond acceptors 6
    Atoms 49
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1528342.