canSAR1711243
FEATURES
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NAMES
    SMILES
    Nc1nonc1-n1nnc(C(=O)NN=Cc2ccc(Br)cc2)c1-c1ccc2c(c1)OCO2
    InChI
    InChI=1S/C19H13BrN8O4/c20-12-4-1-10(2-5-12)8-22-24-19(29)15-16(11-3-6-13-14(7-11)31-9-30-13)28(27-23-15)18-17(21)25-32-26-18/h1-8H,9H2,(H2,21,25)(H,24,29)
    MOLECULAR FORMULA
    C19H13BrN8O4
    CROSS REFERENCES
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    canSAR1711243
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight496.02
    AlogP2.15
    HBond donors3
    HBond acceptors12
    Atoms45
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1711243.