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canSAR1089943
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NAMES
    SMILES
    C[C@H]1CN(Cc2ccn(-c3cccnc3N3CCC(Oc4cccc(F)c4)CC3)n2)CCN1
    InChI
    InChI=1S/C25H31FN6O/c1-19-17-30(15-11-27-19)18-21-7-14-32(29-21)24-6-3-10-28-25(24)31-12-8-22(9-13-31)33-23-5-2-4-20(26)16-23/h2-7,10,14,16,19,22,27H,8-9,11-13,15,17-18H2,1H3/t19-/m0/s1
    MOLECULAR FORMULA
    C25H31FN6O
    CROSS REFERENCES
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    canSAR1089943

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.25
    AlogP 3.25
    HBond donors 1
    HBond acceptors 7
    Atoms 64
    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 canSAR1089943.