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canSAR743185
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NAMES
    SMILES
    NCCCCN(Cc1ccc(Cl)cc1)Cc1ccc(Cl)cc1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C18H22Cl2N2.C2HF3O2/c19-17-7-3-15(4-8-17)13-22(12-2-1-11-21)14-16-5-9-18(20)10-6-16;3-2(4,5)1(6)7/h3-10H,1-2,11-14,21H2;(H,6,7)
    MOLECULAR FORMULA
    C20H23Cl2F3N2O2
    CROSS REFERENCES
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    canSAR743185

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.11
    AlogP 5.37
    HBond donors 3
    HBond acceptors 4
    Atoms 52
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR743185.