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canSAR1089361
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NAMES
    SMILES
    Cc1ccc2c(c1)CC(C)(C)N=C2N[C@@H](Cc1ccccc1)C(=O)O
    InChI
    InChI=1S/C21H24N2O2/c1-14-9-10-17-16(11-14)13-21(2,3)23-19(17)22-18(20(24)25)12-15-7-5-4-6-8-15/h4-11,18H,12-13H2,1-3H3,(H,22,23)(H,24,25)/t18-/m0/s1
    MOLECULAR FORMULA
    C21H24N2O2
    CROSS REFERENCES
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    canSAR1089361

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 336.18
    AlogP 3.36
    HBond donors 2
    HBond acceptors 4
    Atoms 49
    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 canSAR1089361.