canSAR1084277
FEATURES
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NAMES
    SMILES
    C=C(NCCCn1c2c(c3ccc(NC(=O)CCCCC(=O)O)cc3c1=O)C(=O)c1ccccc1-2)OC(C)(C)C
    InChI
    InChI=1S/C31H35N3O6/c1-19(40-31(2,3)4)32-16-9-17-34-28-22-10-5-6-11-23(22)29(38)27(28)21-15-14-20(18-24(21)30(34)39)33-25(35)12-7-8-13-26(36)37/h5-6,10-11,14-15,18,32H,1,7-9,12-13,16-17H2,2-4H3,(H,33,35)(H,36,37)
    MOLECULAR FORMULA
    C31H35N3O6
    CROSS REFERENCES
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    canSAR1084277
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight545.25
    AlogP5.06
    HBond donors3
    HBond acceptors9
    Atoms75
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1084277.