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canSAR1115147
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NAMES
    SMILES
    COc1ccc(-c2ccnc(C(=O)Nc3ccc(Oc4ccnc5cc(OCCCN6CCCC6)c(OC)cc45)c(F)c3)c2)cc1
    InChI
    InChI=1S/C36H35FN4O5/c1-43-27-9-6-24(7-10-27)25-12-14-39-31(20-25)36(42)40-26-8-11-33(29(37)21-26)46-32-13-15-38-30-23-35(34(44-2)22-28(30)32)45-19-5-18-41-16-3-4-17-41/h6-15,20-23H,3-5,16-19H2,1-2H3,(H,40,42)
    MOLECULAR FORMULA
    C36H35FN4O5
    CROSS REFERENCES
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    canSAR1115147

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 622.26
    AlogP 7.36
    HBond donors 1
    HBond acceptors 9
    Atoms 81
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1115147.