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canSAR1430059
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NAMES
    SMILES
    C[C@@H]1ON(C2CCCCC2)[C@H]2c3nc4ccccc4n3C[C@@H]12
    InChI
    InChI=1S/C18H23N3O/c1-12-14-11-20-16-10-6-5-9-15(16)19-18(20)17(14)21(22-12)13-7-3-2-4-8-13/h5-6,9-10,12-14,17H,2-4,7-8,11H2,1H3/t12-,14-,17+/m0/s1
    MOLECULAR FORMULA
    C18H23N3O
    CROSS REFERENCES
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    canSAR1430059

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.18
    AlogP 3.68
    HBond donors 0
    HBond acceptors 4
    Atoms 45
    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 canSAR1430059.