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canSAR2085231
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NAMES
    SMILES
    Cc1c[nH]c2ncc(-c3cc([C@@H]4CCOC4)n([C@@H]4CCC(F)(F)C4)n3)cc12
    InChI
    InChI=1S/C20H22F2N4O/c1-12-9-23-19-16(12)6-14(10-24-19)17-7-18(13-3-5-27-11-13)26(25-17)15-2-4-20(21,22)8-15/h6-7,9-10,13,15H,2-5,8,11H2,1H3,(H,23,24)/t13-,15-/m1/s1
    MOLECULAR FORMULA
    C20H22F2N4O
    CROSS REFERENCES
    2085231 logo

    canSAR2085231

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 372.18
    AlogP 4.60
    HBond donors 1
    HBond acceptors 5
    Atoms 49
    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 canSAR2085231.