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canSAR1832375
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NAMES
    SMILES
    CC(C)O.COc1cccc(C2C3=C(O)CC(C)(C)CC3=Nc3[nH]nc(C)c32)c1
    InChI
    InChI=1S/C20H23N3O2.C3H8O/c1-11-16-17(12-6-5-7-13(8-12)25-4)18-14(21-19(16)23-22-11)9-20(2,3)10-15(18)24;1-3(2)4/h5-8,17,24H,9-10H2,1-4H3,(H,22,23);3-4H,1-2H3
    MOLECULAR FORMULA
    C23H31N3O3
    CROSS REFERENCES
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    canSAR1832375

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.24
    AlogP 4.96
    HBond donors 3
    HBond acceptors 6
    Atoms 60
    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 canSAR1832375.