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canSAR2087131
FEATURES
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NAMES
    SMILES
    O=C(C1CC(F)(F)C1)N1C[C@@H]2CN(CC3CC3)CCO[C@@H]2C1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C16H24F2N2O2.C2HF3O2/c17-16(18)5-12(6-16)15(21)20-9-13-8-19(7-11-1-2-11)3-4-22-14(13)10-20;3-2(4,5)1(6)7/h11-14H,1-10H2;(H,6,7)/t13-,14+;/m0./s1
    MOLECULAR FORMULA
    C18H25F5N2O4
    CROSS REFERENCES
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    canSAR2087131

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.17
    AlogP 2.23
    HBond donors 1
    HBond acceptors 6
    Atoms 54
    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 canSAR2087131.