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canSAR1830838
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NAMES
    SMILES
    CC(C)C(=O)N1c2nc(-c3ccco3)nn2C2(CCCCC2)[C@@H]2CCCC[C@@H]21
    InChI
    InChI=1S/C22H30N4O2/c1-15(2)20(27)25-17-10-5-4-9-16(17)22(12-6-3-7-13-22)26-21(25)23-19(24-26)18-11-8-14-28-18/h8,11,14-17H,3-7,9-10,12-13H2,1-2H3/t16-,17+/m1/s1
    MOLECULAR FORMULA
    C22H30N4O2
    CROSS REFERENCES
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    canSAR1830838

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 382.24
    AlogP 4.76
    HBond donors 0
    HBond acceptors 6
    Atoms 58
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1830838.