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canSAR1146500
FEATURES
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NAMES
    SMILES
    Cc1ccc(NC(=O)c2ccc(Cl)cc2OC(=O)[C@@H](Cc2cc3ccccc3[nH]2)NC(=O)OCc2ccccc2)cc1
    InChI
    InChI=1S/C33H28ClN3O5/c1-21-11-14-25(15-12-21)36-31(38)27-16-13-24(34)18-30(27)42-32(39)29(19-26-17-23-9-5-6-10-28(23)35-26)37-33(40)41-20-22-7-3-2-4-8-22/h2-18,29,35H,19-20H2,1H3,(H,36,38)(H,37,40)/t29-/m1/s1
    MOLECULAR FORMULA
    C33H28ClN3O5
    CROSS REFERENCES
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    canSAR1146500

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 581.17
    AlogP 6.83
    HBond donors 3
    HBond acceptors 8
    Atoms 70
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1146500.