canSAR2170621
FEATURES
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NAMES
    SMILES
    O=C(Nc1ccc(CNc2nc(N3CCCC3)nc3ccc(C(F)(F)F)cc23)cc1)c1ccc(Cl)cc1
    InChI
    InChI=1S/C27H23ClF3N5O/c28-20-8-5-18(6-9-20)25(37)33-21-10-3-17(4-11-21)16-32-24-22-15-19(27(29,30)31)7-12-23(22)34-26(35-24)36-13-1-2-14-36/h3-12,15H,1-2,13-14,16H2,(H,33,37)(H,32,34,35)
    MOLECULAR FORMULA
    C27H23ClF3N5O
    CROSS REFERENCES
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    canSAR2170621
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight525.15
    AlogP6.77
    HBond donors2
    HBond acceptors6
    Atoms60
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2170621.