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canSAR1647122
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NAMES
    SMILES
    COC1(c2cn(C3=NCC(=O)N4CCc5c(cccc5-c5ccc(F)nc5)C4=C3)cn2)CC1
    InChI
    InChI=1S/C25H22FN5O2/c1-33-25(8-9-25)21-14-30(15-29-21)23-11-20-19-4-2-3-17(16-5-6-22(26)27-12-16)18(19)7-10-31(20)24(32)13-28-23/h2-6,11-12,14-15H,7-10,13H2,1H3
    MOLECULAR FORMULA
    C25H22FN5O2
    CROSS REFERENCES
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    canSAR1647122

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.18
    AlogP 3.41
    HBond donors 0
    HBond acceptors 7
    Atoms 55
    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 canSAR1647122.