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canSAR2086606
FEATURES
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NAMES
    SMILES
    Cc1ccc(N2C[C@H]3OCCN(C(=O)c4ccccc4)C[C@H]3C2)nn1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C19H22N4O2.C2HF3O2/c1-14-7-8-18(21-20-14)23-12-16-11-22(9-10-25-17(16)13-23)19(24)15-5-3-2-4-6-15;3-2(4,5)1(6)7/h2-8,16-17H,9-13H2,1H3;(H,6,7)/t16-,17+;/m0./s1
    MOLECULAR FORMULA
    C21H23F3N4O4
    CROSS REFERENCES
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    canSAR2086606

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.17
    AlogP 2.40
    HBond donors 1
    HBond acceptors 8
    Atoms 55
    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 canSAR2086606.