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canSAR1129698
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NAMES
    SMILES
    CCOc1cc2c(N3CCN(c4ccc(OC)cc4OC)CC3)nc(-c3ccccc3)nc2cc1OC
    InChI
    InChI=1S/C29H32N4O4/c1-5-37-27-18-22-23(19-26(27)36-4)30-28(20-9-7-6-8-10-20)31-29(22)33-15-13-32(14-16-33)24-12-11-21(34-2)17-25(24)35-3/h6-12,17-19H,5,13-16H2,1-4H3
    MOLECULAR FORMULA
    C29H32N4O4
    CROSS REFERENCES
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    canSAR1129698

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 500.24
    AlogP 5.05
    HBond donors 0
    HBond acceptors 8
    Atoms 69
    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 canSAR1129698.