canSAR2155339
FEATURES
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NAMES
    SMILES
    C#Cc1cc(Nc2nccc(Oc3ccc(NC(=O)Nc4cc(C(C)(C)C)cc(C(=O)NC)c4OC)c4ccccc34)n2)cc(C(=O)NCCN2CCOCC2)c1
    InChI
    InChI=1S/C43H46N8O6/c1-7-27-22-28(39(52)45-16-17-51-18-20-56-21-19-51)24-30(23-27)47-41-46-15-14-37(50-41)57-36-13-12-34(31-10-8-9-11-32(31)36)48-42(54)49-35-26-29(43(2,3)4)25-33(38(35)55-6)40(53)44-5/h1,8-15,22-26H,16-21H2,2-6H3,(H,44,53)(H,45,52)(H,46,47,50)(H2,48,49,54)
    MOLECULAR FORMULA
    C43H46N8O6
    CROSS REFERENCES
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    canSAR2155339
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight770.35
    AlogP6.52
    HBond donors5
    HBond acceptors14
    Atoms103
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2155339.