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canSAR644369
FEATURES
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NAMES
    SMILES
    O=S(=O)(O)c1cc(S(=O)(=O)O)c2c(Nc3ccnc4ccccc34)ccc(S(=O)(=O)O)c2c1
    InChI
    InChI=1S/C19H14N2O9S3/c22-31(23,24)11-9-13-17(32(25,26)27)6-5-16(19(13)18(10-11)33(28,29)30)21-15-7-8-20-14-4-2-1-3-12(14)15/h1-10H,(H,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)
    MOLECULAR FORMULA
    C19H14N2O9S3
    CROSS REFERENCES
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    canSAR644369

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 509.99
    AlogP 2.87
    HBond donors 4
    HBond acceptors 11
    Atoms 47
    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 canSAR644369.