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canSAR1765730
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NAMES
    SMILES
    CN(C)CCCON=C(c1ccccc1)c1ccncc1.O=C(O)C(=O)O
    InChI
    InChI=1S/C17H21N3O.C2H2O4/c1-20(2)13-6-14-21-19-17(15-7-4-3-5-8-15)16-9-11-18-12-10-16;3-1(4)2(5)6/h3-5,7-12H,6,13-14H2,1-2H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C19H23N3O5
    CROSS REFERENCES
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    canSAR1765730

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 373.16
    AlogP 1.96
    HBond donors 2
    HBond acceptors 8
    Atoms 50
    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 canSAR1765730.