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canSAR2088502
FEATURES
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NAMES
    SMILES
    Cc1cc(C[C@@H]2CCC[C@H]2NCc2cccc(F)c2F)on1.O=C(O)CC(O)(CC(=O)O)C(=O)O
    InChI
    InChI=1S/C17H20F2N2O.C6H8O7/c1-11-8-14(22-21-11)9-12-4-3-7-16(12)20-10-13-5-2-6-15(18)17(13)19;7-3(8)1-6(13,5(11)12)2-4(9)10/h2,5-6,8,12,16,20H,3-4,7,9-10H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t12-,16+;/m0./s1
    MOLECULAR FORMULA
    C23H28F2N2O8
    CROSS REFERENCES
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    canSAR2088502

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 498.18
    AlogP 2.51
    HBond donors 5
    HBond acceptors 10
    Atoms 63
    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 canSAR2088502.