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canSAR563577
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NAMES
    SMILES
    CCOC(=O)Cc1csc(NCc2cc(Br)cc3nc(O)c(O)nc23)n1
    InChI
    InChI=1S/C16H15BrN4O4S/c1-2-25-12(22)5-10-7-26-16(19-10)18-6-8-3-9(17)4-11-13(8)21-15(24)14(23)20-11/h3-4,7H,2,5-6H2,1H3,(H,18,19)(H,20,23)(H,21,24)
    MOLECULAR FORMULA
    C16H15BrN4O4S
    CROSS REFERENCES
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    canSAR563577

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.00
    AlogP 2.98
    HBond donors 3
    HBond acceptors 8
    Atoms 41
    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 canSAR563577.