canSAR611946
FEATURES
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NAMES
    SMILES
    CC1(C)CC(=O)c2c(nc3ccc4ccccc4c3c2-c2ccc(NC(=O)CCCC(=O)Nc3ccc(-c4c5c(nc6ccc7ccccc7c46)CC(C)(C)CC5=O)cc3)cc2)C1
    InChI
    InChI=1S/C55H48N4O4/c1-54(2)28-42-52(44(60)30-54)48(50-38-12-7-5-10-32(38)20-26-40(50)58-42)34-16-22-36(23-17-34)56-46(62)14-9-15-47(63)57-37-24-18-35(19-25-37)49-51-39-13-8-6-11-33(39)21-27-41(51)59-43-29-55(3,4)31-45(61)53(43)49/h5-8,10-13,16-27H,9,14-15,28-31H2,1-4H3,(H,56,62)(H,57,63)
    MOLECULAR FORMULA
    C55H48N4O4
    CROSS REFERENCES
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    canSAR611946
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight828.37
    AlogP12.48
    HBond donors2
    HBond acceptors8
    Atoms111
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR611946.