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canSAR1965334
FEATURES
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NAMES
    SMILES
    C/C=C/C(=O)N1CC2(CC(c3cccc(NC(=O)CC)c3)=NO2)C[C@H]1C(N)=O
    InChI
    InChI=1S/C20H24N4O4/c1-3-6-18(26)24-12-20(11-16(24)19(21)27)10-15(23-28-20)13-7-5-8-14(9-13)22-17(25)4-2/h3,5-9,16H,4,10-12H2,1-2H3,(H2,21,27)(H,22,25)/b6-3+/t16-,20?/m0/s1
    MOLECULAR FORMULA
    C20H24N4O4
    CROSS REFERENCES
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    canSAR1965334

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 384.18
    AlogP 1.56
    HBond donors 3
    HBond acceptors 8
    Atoms 52
    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 canSAR1965334.