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canSAR1587474
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NAMES
    SMILES
    COc1ccc(N2CCN(C(=O)CN3C(=O)NC4(CCCc5ccccc54)C3=O)CC2)cc1
    InChI
    InChI=1S/C25H28N4O4/c1-33-20-10-8-19(9-11-20)27-13-15-28(16-14-27)22(30)17-29-23(31)25(26-24(29)32)12-4-6-18-5-2-3-7-21(18)25/h2-3,5,7-11H,4,6,12-17H2,1H3,(H,26,32)
    MOLECULAR FORMULA
    C25H28N4O4
    CROSS REFERENCES
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    canSAR1587474

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.21
    AlogP 2.13
    HBond donors 1
    HBond acceptors 8
    Atoms 61
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1587474.