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canSAR1615468
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NAMES
    SMILES
    CCc1ccc(NC(=O)CSc2nnc3[nH]c(=O)cc(-c4ccccc4)n23)cc1
    InChI
    InChI=1S/C21H19N5O2S/c1-2-14-8-10-16(11-9-14)22-19(28)13-29-21-25-24-20-23-18(27)12-17(26(20)21)15-6-4-3-5-7-15/h3-12H,2,13H2,1H3,(H,22,28)(H,23,24,27)
    MOLECULAR FORMULA
    C21H19N5O2S
    CROSS REFERENCES
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    canSAR1615468

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.13
    AlogP 3.38
    HBond donors 2
    HBond acceptors 7
    Atoms 48
    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 canSAR1615468.