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canSAR561886
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NAMES
    SMILES
    COc1cc(F)c2ncc(Cl)c([C@@H](O)CN3CCC(NCc4cc5c(cn4)OCCO5)CC3)c2c1
    InChI
    InChI=1S/C25H28ClFN4O4/c1-33-17-9-18-24(19(26)12-30-25(18)20(27)10-17)21(32)14-31-4-2-15(3-5-31)28-11-16-8-22-23(13-29-16)35-7-6-34-22/h8-10,12-13,15,21,28,32H,2-7,11,14H2,1H3/t21-/m0/s1
    MOLECULAR FORMULA
    C25H28ClFN4O4
    CROSS REFERENCES
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    canSAR561886

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.18
    AlogP 3.49
    HBond donors 2
    HBond acceptors 8
    Atoms 63
    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 canSAR561886.