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canSAR1617174
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NAMES
    SMILES
    O=C(Nc1ccc(F)cc1)N1CCN(c2ccc3nnc(-c4ccc(F)cc4)n3n2)CC1
    InChI
    InChI=1S/C22H19F2N7O/c23-16-3-1-15(2-4-16)21-27-26-19-9-10-20(28-31(19)21)29-11-13-30(14-12-29)22(32)25-18-7-5-17(24)6-8-18/h1-10H,11-14H2,(H,25,32)
    MOLECULAR FORMULA
    C22H19F2N7O
    CROSS REFERENCES
    1617174 logo

    canSAR1617174

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.16
    AlogP 3.42
    HBond donors 1
    HBond acceptors 8
    Atoms 51
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1617174.