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canSAR929733
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NAMES
    SMILES
    CNC(=O)c1cn2c(C)c(C)nc2c2c1CC[C@H](c1ccccc1)O2
    InChI
    InChI=1S/C20H21N3O2/c1-12-13(2)23-11-16(20(24)21-3)15-9-10-17(14-7-5-4-6-8-14)25-18(15)19(23)22-12/h4-8,11,17H,9-10H2,1-3H3,(H,21,24)/t17-/m1/s1
    MOLECULAR FORMULA
    C20H21N3O2
    CROSS REFERENCES
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    canSAR929733

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 335.16
    AlogP 3.38
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    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 canSAR929733.