canSAR2080252
FEATURES
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NAMES
    SMILES
    COc1cc(CCc2cc(Nc3ncnc4cccc(Cl)c34)n[nH]2)cc(OC)c1
    InChI
    InChI=1S/C21H20ClN5O2/c1-28-15-8-13(9-16(11-15)29-2)6-7-14-10-19(27-26-14)25-21-20-17(22)4-3-5-18(20)23-12-24-21/h3-5,8-12H,6-7H2,1-2H3,(H2,23,24,25,26,27)
    MOLECULAR FORMULA
    C21H20ClN5O2
    CROSS REFERENCES
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    canSAR2080252
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight409.13
    AlogP4.55
    HBond donors2
    HBond acceptors7
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080252.