canSAR2059471
FEATURES
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NAMES
    SMILES
    COc1cc2c(cc1OCCCCNC(=O)c1cc(OC)c(OC)c(OC)c1)N=C[C@@H]1CCCN1C2=O
    InChI
    InChI=1S/C27H33N3O7/c1-33-21-14-19-20(29-16-18-8-7-10-30(18)27(19)32)15-22(21)37-11-6-5-9-28-26(31)17-12-23(34-2)25(36-4)24(13-17)35-3/h12-16,18H,5-11H2,1-4H3,(H,28,31)/t18-/m0/s1
    MOLECULAR FORMULA
    C27H33N3O7
    CROSS REFERENCES
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    canSAR2059471
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight511.23
    AlogP3.63
    HBond donors1
    HBond acceptors10
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2059471.