canSAR2080214
FEATURES
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NAMES
    SMILES
    N#Cc1cc(C(F)(F)F)ccc1N1CCc2ncnc(NCc3ccc(C(F)(F)F)nc3)c2C1
    InChI
    InChI=1S/C22H16F6N6/c23-21(24,25)15-2-3-18(14(7-15)8-29)34-6-5-17-16(11-34)20(33-12-32-17)31-10-13-1-4-19(30-9-13)22(26,27)28/h1-4,7,9,12H,5-6,10-11H2,(H,31,32,33)
    MOLECULAR FORMULA
    C22H16F6N6
    CROSS REFERENCES
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    canSAR2080214
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight478.13
    AlogP4.96
    HBond donors1
    HBond acceptors6
    Atoms50
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080214.