canSAR2157666
FEATURES
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NAMES
    SMILES
    O=C(CN1CCOCC1)N1CCC(CNc2ccc3ncc(-c4cccc(OC(F)(F)F)c4)n3n2)CC1
    InChI
    InChI=1S/C25H29F3N6O3/c26-25(27,28)37-20-3-1-2-19(14-20)21-16-30-23-5-4-22(31-34(21)23)29-15-18-6-8-33(9-7-18)24(35)17-32-10-12-36-13-11-32/h1-5,14,16,18H,6-13,15,17H2,(H,29,31)
    MOLECULAR FORMULA
    C25H29F3N6O3
    CROSS REFERENCES
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    canSAR2157666
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight518.23
    AlogP3.28
    HBond donors1
    HBond acceptors9
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2157666.