canSAR63373
FEATURES
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NAMES
    SMILES
    COC(=O)[C@]1(O)C[C@H](n2c3ccccc3c3c4c(c5c6ccccc6[nH]c5c32)CNC4=O)OC1(C)C
    InChI
    InChI=1S/C28H25N3O5/c1-27(2)28(34,26(33)35-3)12-19(36-27)31-18-11-7-5-9-15(18)21-22-16(13-29-25(22)32)20-14-8-4-6-10-17(14)30-23(20)24(21)31/h4-11,19,30,34H,12-13H2,1-3H3,(H,29,32)/t19-,28-/m1/s1
    MOLECULAR FORMULA
    C28H25N3O5
    CROSS REFERENCES
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    canSAR63373
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight483.18
    AlogP4.27
    HBond donors3
    HBond acceptors8
    Atoms61
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR63373.