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canSAR2084394
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NAMES
    SMILES
    O=C(NO)[C@H]1CN(c2ccc(C#Cc3ccc(CN4CCOCC4)cc3)cc2)C(=O)O1
    InChI
    InChI=1S/C23H23N3O5/c27-22(24-29)21-16-26(23(28)31-21)20-9-7-18(8-10-20)2-1-17-3-5-19(6-4-17)15-25-11-13-30-14-12-25/h3-10,21,29H,11-16H2,(H,24,27)/t21-/m1/s1
    MOLECULAR FORMULA
    C23H23N3O5
    CROSS REFERENCES
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    canSAR2084394

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 421.16
    AlogP 1.75
    HBond donors 2
    HBond acceptors 8
    Atoms 54
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2084394.