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canSAR2003580
FEATURES
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NAMES
    SMILES
    COc1cccc(CN2CCN(C(=O)c3cccc4ccccc34)CC2)c1OC.O=C(O)C(=O)O
    InChI
    InChI=1S/C24H26N2O3.C2H2O4/c1-28-22-12-6-9-19(23(22)29-2)17-25-13-15-26(16-14-25)24(27)21-11-5-8-18-7-3-4-10-20(18)21;3-1(4)2(5)6/h3-12H,13-17H2,1-2H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C26H28N2O7
    CROSS REFERENCES
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    canSAR2003580

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.19
    AlogP 2.97
    HBond donors 2
    HBond acceptors 9
    Atoms 63
    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 canSAR2003580.