canSAR2059868
FEATURES
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NAMES
    SMILES
    Cl.Cl.Cl.Cn1c(N2CCO[C@@H](c3ccc(OCCCN4CCOCC4)cc3)C2)nc(-c2ccncc2F)cc1=O
    InChI
    InChI=1S/C27H32FN5O4.3ClH/c1-31-26(34)17-24(22-7-8-29-18-23(22)28)30-27(31)33-12-16-37-25(19-33)20-3-5-21(6-4-20)36-13-2-9-32-10-14-35-15-11-32;;;/h3-8,17-18,25H,2,9-16,19H2,1H3;3*1H/t25-;;;/m1.../s1
    MOLECULAR FORMULA
    C27H35Cl3FN5O4
    CROSS REFERENCES
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    canSAR2059868
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight617.17
    AlogP3.93
    HBond donors0
    HBond acceptors9
    Atoms75
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2059868.