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canSAR1961390
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NAMES
    SMILES
    CN(C)C(=O)c1c(CNC(=O)c2ccc3ncsc3c2)c(=O)c2ccc(Cl)cc2n1-c1ccccc1
    InChI
    InChI=1S/C27H21ClN4O3S/c1-31(2)27(35)24-20(14-29-26(34)16-8-11-21-23(12-16)36-15-30-21)25(33)19-10-9-17(28)13-22(19)32(24)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3,(H,29,34)
    MOLECULAR FORMULA
    C27H21ClN4O3S
    CROSS REFERENCES
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    canSAR1961390

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 516.10
    AlogP 4.89
    HBond donors 1
    HBond acceptors 7
    Atoms 57
    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 canSAR1961390.