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canSAR2001594
FEATURES
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NAMES
    SMILES
    CCc1cccc(CC)c1NC(=O)C[n+]1cccc(C(N)=O)c1.[Cl-]
    InChI
    InChI=1S/C18H21N3O2.ClH/c1-3-13-7-5-8-14(4-2)17(13)20-16(22)12-21-10-6-9-15(11-21)18(19)23;/h5-11H,3-4,12H2,1-2H3,(H2-,19,20,22,23);1H
    MOLECULAR FORMULA
    C18H22ClN3O2
    CROSS REFERENCES
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    canSAR2001594

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 347.14
    AlogP -1.16
    HBond donors 3
    HBond acceptors 5
    Atoms 46
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2001594.