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canSAR782800
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NAMES
    SMILES
    CCn1c(=O)n([C@@H]2CCN(C[C@@H]3C[C@@H]4CC[C@H]3C4)C[C@H]2CO)c2ccccc21
    InChI
    InChI=1S/C23H33N3O2/c1-2-25-21-5-3-4-6-22(21)26(23(25)28)20-9-10-24(14-19(20)15-27)13-18-12-16-7-8-17(18)11-16/h3-6,16-20,27H,2,7-15H2,1H3/t16-,17+,18+,19+,20-/m1/s1
    MOLECULAR FORMULA
    C23H33N3O2
    CROSS REFERENCES
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    canSAR782800

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.26
    AlogP 3.11
    HBond donors 1
    HBond acceptors 5
    Atoms 61
    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 canSAR782800.