canSAR2171398
FEATURES
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NAMES
    SMILES
    CN[C@@H](C)C(=O)N[C@H]1COc2c(C(=O)O)cccc2N(Cc2c(OC)ccc3ccccc23)C1=O
    InChI
    InChI=1S/C26H27N3O6/c1-15(27-2)24(30)28-20-14-35-23-18(26(32)33)9-6-10-21(23)29(25(20)31)13-19-17-8-5-4-7-16(17)11-12-22(19)34-3/h4-12,15,20,27H,13-14H2,1-3H3,(H,28,30)(H,32,33)/t15-,20-/m0/s1
    MOLECULAR FORMULA
    C26H27N3O6
    CROSS REFERENCES
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    canSAR2171398
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight477.19
    AlogP2.56
    HBond donors3
    HBond acceptors9
    Atoms62
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2171398.