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canSAR1529843
FEATURES
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NAMES
    SMILES
    CCN(C(=O)CN1CCN(C)CC1)c1cccc2ccccc12.O=C(O)C(=O)O
    InChI
    InChI=1S/C19H25N3O.C2H2O4/c1-3-22(19(23)15-21-13-11-20(2)12-14-21)18-10-6-8-16-7-4-5-9-17(16)18;3-1(4)2(5)6/h4-10H,3,11-15H2,1-2H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C21H27N3O5
    CROSS REFERENCES
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    canSAR1529843

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.20
    AlogP 1.60
    HBond donors 2
    HBond acceptors 8
    Atoms 56
    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 canSAR1529843.