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canSAR1126698
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NAMES
    SMILES
    COc1ccc(-c2cc(C(=O)Nc3nc4ccc(Cl)cc4s3)nc3cc(-c4ccccc4)nn23)cc1
    InChI
    InChI=1S/C27H18ClN5O2S/c1-35-19-10-7-17(8-11-19)23-14-22(26(34)31-27-30-20-12-9-18(28)13-24(20)36-27)29-25-15-21(32-33(23)25)16-5-3-2-4-6-16/h2-15H,1H3,(H,30,31,34)
    MOLECULAR FORMULA
    C27H18ClN5O2S
    CROSS REFERENCES
    1126698 logo

    canSAR1126698

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 511.09
    AlogP 6.59
    HBond donors 1
    HBond acceptors 7
    Atoms 54
    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 canSAR1126698.