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canSAR987459
FEATURES
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NAMES
    SMILES
    COc1ccc(NC(=O)[C@@H]2Cc3ccc(OCC(=O)NO)cc3CN2C(=O)CNC(=O)OC(C)(C)C)cc1
    InChI
    InChI=1S/C26H32N4O8/c1-26(2,3)38-25(34)27-13-23(32)30-14-17-11-20(37-15-22(31)29-35)8-5-16(17)12-21(30)24(33)28-18-6-9-19(36-4)10-7-18/h5-11,21,35H,12-15H2,1-4H3,(H,27,34)(H,28,33)(H,29,31)/t21-/m0/s1
    MOLECULAR FORMULA
    C26H32N4O8
    CROSS REFERENCES
    987459 logo

    canSAR987459

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 528.22
    AlogP 2.00
    HBond donors 4
    HBond acceptors 12
    Atoms 70
    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 canSAR987459.