canSAR820308
FEATURES
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NAMES
    SMILES
    Cc1cn2c(-c3cn[nH]c3)cnc2c(Nc2cc(CN3CCN(C)C(=O)C3)ns2)n1
    InChI
    InChI=1S/C19H21N9OS/c1-12-9-28-15(13-6-21-22-7-13)8-20-19(28)18(23-12)24-16-5-14(25-30-16)10-27-4-3-26(2)17(29)11-27/h5-9H,3-4,10-11H2,1-2H3,(H,21,22)(H,23,24)
    MOLECULAR FORMULA
    C19H21N9OS
    CROSS REFERENCES
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    canSAR820308
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight423.16
    AlogP1.90
    HBond donors2
    HBond acceptors10
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR820308.