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canSAR987510
FEATURES
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NAMES
    SMILES
    COc1cc(/C=N/NC(=O)CSc2cc(C)nc3ccccc23)ccc1C#N
    InChI
    InChI=1S/C21H18N4O2S/c1-14-9-20(17-5-3-4-6-18(17)24-14)28-13-21(26)25-23-12-15-7-8-16(11-22)19(10-15)27-2/h3-10,12H,13H2,1-2H3,(H,25,26)/b23-12+
    MOLECULAR FORMULA
    C21H18N4O2S
    CROSS REFERENCES
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    canSAR987510

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 390.12
    AlogP 3.67
    HBond donors 1
    HBond acceptors 6
    Atoms 46
    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 canSAR987510.