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canSAR1090660
FEATURES
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NAMES
    SMILES
    COc1cc(/C=C/C(=O)NO)ccc1OC[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C
    InChI
    InChI=1S/C32H42N4O7/c1-20(2)15-26(35-31(39)43-32(3,4)5)30(38)34-23(17-22-18-33-25-10-8-7-9-24(22)25)19-42-27-13-11-21(16-28(27)41-6)12-14-29(37)36-40/h7-14,16,18,20,23,26,33,40H,15,17,19H2,1-6H3,(H,34,38)(H,35,39)(H,36,37)/b14-12+/t23-,26-/m0/s1
    MOLECULAR FORMULA
    C32H42N4O7
    CROSS REFERENCES
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    canSAR1090660

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 594.31
    AlogP 4.74
    HBond donors 5
    HBond acceptors 11
    Atoms 85
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1090660.