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canSAR1648303
FEATURES
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NAMES
    SMILES
    CCN1CCC2(CC1)CC(N1CCC3(CC1)C(=O)NCN3c1ccccc1)c1ccccc1O2.O=C(O)C(=O)O
    InChI
    InChI=1S/C28H36N4O2.C2H2O4/c1-2-30-16-12-27(13-17-30)20-24(23-10-6-7-11-25(23)34-27)31-18-14-28(15-19-31)26(33)29-21-32(28)22-8-4-3-5-9-22;3-1(4)2(5)6/h3-11,24H,2,12-21H2,1H3,(H,29,33);(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C30H38N4O6
    CROSS REFERENCES
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    canSAR1648303

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 550.28
    AlogP 2.95
    HBond donors 3
    HBond acceptors 10
    Atoms 78
    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 canSAR1648303.