canSAR621706
FEATURES
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NAMES
    SMILES
    Cc1cnoc1NS(=O)(=O)c1ccc(Nc2nnc(/C=C/c3c(O)ccc4ccccc34)c(=O)n2N)cc1
    InChI
    InChI=1S/C25H21N7O5S/c1-15-14-27-37-23(15)31-38(35,36)18-9-7-17(8-10-18)28-25-30-29-21(24(34)32(25)26)12-11-20-19-5-3-2-4-16(19)6-13-22(20)33/h2-14,31,33H,26H2,1H3,(H,28,30)/b12-11+
    MOLECULAR FORMULA
    C25H21N7O5S
    CROSS REFERENCES
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    canSAR621706
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight531.13
    AlogP3.22
    HBond donors5
    HBond acceptors12
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR621706.