canSAR2095113
FEATURES
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NAMES
    SMILES
    Cc1cnc(-c2n[nH]cc2CN2CCN(c3ccc(C(F)(F)F)cn3)[C@H](C)C2)[nH]1
    InChI
    InChI=1S/C19H22F3N7/c1-12-7-24-18(26-12)17-14(8-25-27-17)11-28-5-6-29(13(2)10-28)16-4-3-15(9-23-16)19(20,21)22/h3-4,7-9,13H,5-6,10-11H2,1-2H3,(H,24,26)(H,25,27)/t13-/m1/s1
    MOLECULAR FORMULA
    C19H22F3N7
    CROSS REFERENCES
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    canSAR2095113
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight405.19
    AlogP3.23
    HBond donors2
    HBond acceptors7
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095113.