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canSAR1618949
FEATURES
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NAMES
    SMILES
    Cc1cc2occ(CC(=O)N(CCC(C)C)c3c(N)n(Cc4ccccc4)c(=O)[nH]c3=O)c2cc1C
    InChI
    InChI=1S/C28H32N4O4/c1-17(2)10-11-31(24(33)14-21-16-36-23-13-19(4)18(3)12-22(21)23)25-26(29)32(28(35)30-27(25)34)15-20-8-6-5-7-9-20/h5-9,12-13,16-17H,10-11,14-15,29H2,1-4H3,(H,30,34,35)
    MOLECULAR FORMULA
    C28H32N4O4
    CROSS REFERENCES
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    canSAR1618949

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.24
    AlogP 4.15
    HBond donors 3
    HBond acceptors 8
    Atoms 68
    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 canSAR1618949.