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canSAR1208319
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NAMES
    SMILES
    NC(=S)N/N=C1/C=C(Nc2ccc(Cl)cc2)C(Nc2ccc(Cl)cc2)=NC1=O
    InChI
    InChI=1S/C18H14Cl2N6OS/c19-10-1-5-12(6-2-10)22-14-9-15(25-26-18(21)28)17(27)24-16(14)23-13-7-3-11(20)4-8-13/h1-9,22H,(H3,21,26,28)(H,23,24,27)/b25-15-
    MOLECULAR FORMULA
    C18H14Cl2N6OS
    CROSS REFERENCES
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    canSAR1208319

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.03
    AlogP 3.53
    HBond donors 5
    HBond acceptors 7
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1208319.