canSAR1587273
FEATURES
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NAMES
    SMILES
    CCNC(=O)Nc1ccc(CCCCc2nnc(NC(=O)Cc3cccc(CN)c3)s2)nn1
    InChI
    InChI=1S/C22H28N8O2S/c1-2-24-21(32)25-18-11-10-17(27-28-18)8-3-4-9-20-29-30-22(33-20)26-19(31)13-15-6-5-7-16(12-15)14-23/h5-7,10-12H,2-4,8-9,13-14,23H2,1H3,(H,26,30,31)(H2,24,25,28,32)
    MOLECULAR FORMULA
    C22H28N8O2S
    CROSS REFERENCES
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    canSAR1587273
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight468.21
    AlogP2.67
    HBond donors5
    HBond acceptors10
    Atoms61
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1587273.