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canSAR913701
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NAMES
    SMILES
    CC(C)(O)[C@@H]1CNC[C@H]1Nc1nc(-c2cc(F)ccc2O)nc2ccccc12
    InChI
    InChI=1S/C21H23FN4O2/c1-21(2,28)15-10-23-11-17(15)25-19-13-5-3-4-6-16(13)24-20(26-19)14-9-12(22)7-8-18(14)27/h3-9,15,17,23,27-28H,10-11H2,1-2H3,(H,24,25,26)/t15-,17-/m1/s1
    MOLECULAR FORMULA
    C21H23FN4O2
    CROSS REFERENCES
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    canSAR913701

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 382.18
    AlogP 2.91
    HBond donors 4
    HBond acceptors 6
    Atoms 51
    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 canSAR913701.