canSAR389752
FEATURES
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NAMES
    SMILES
    C=C(Br)C(=O)Nc1ccc2[nH]c(C(=O)NCCNC(=O)c3cc(OCC4(c5ccc(-c6ccccc6)cc5)CC(=C)C(=O)O4)nn3C)cc2c1
    InChI
    InChI=1S/C37H33BrN6O6/c1-22-20-37(50-36(22)48,27-11-9-25(10-12-27)24-7-5-4-6-8-24)21-49-32-19-31(44(3)43-32)35(47)40-16-15-39-34(46)30-18-26-17-28(13-14-29(26)42-30)41-33(45)23(2)38/h4-14,17-19,42H,1-2,15-16,20-21H2,3H3,(H,39,46)(H,40,47)(H,41,45)
    MOLECULAR FORMULA
    C37H33BrN6O6
    CROSS REFERENCES
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    canSAR389752
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight736.16
    AlogP5.35
    HBond donors4
    HBond acceptors12
    Atoms83
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR389752.