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canSAR1768198
FEATURES
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NAMES
    SMILES
    CCN1C(NCc2cccc(C(F)(F)F)c2)=N[C@@H](c2cccc(C(F)(F)F)c2)C(C(=O)OC)=C1C
    InChI
    InChI=1S/C24H23F6N3O2/c1-4-33-14(2)19(21(34)35-3)20(16-8-6-10-18(12-16)24(28,29)30)32-22(33)31-13-15-7-5-9-17(11-15)23(25,26)27/h5-12,20H,4,13H2,1-3H3,(H,31,32)/t20-/m0/s1
    MOLECULAR FORMULA
    C24H23F6N3O2
    CROSS REFERENCES
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    canSAR1768198

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 499.17
    AlogP 5.69
    HBond donors 1
    HBond acceptors 5
    Atoms 58
    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 canSAR1768198.