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canSAR1204527
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NAMES
    SMILES
    N#C[C@@H]1CCCN1C(=O)CNC(=O)c1ccnc2[nH]c(-c3ccc(F)cc3)nc12
    InChI
    InChI=1S/C20H17FN6O2/c21-13-5-3-12(4-6-13)18-25-17-15(7-8-23-19(17)26-18)20(29)24-11-16(28)27-9-1-2-14(27)10-22/h3-8,14H,1-2,9,11H2,(H,24,29)(H,23,25,26)/t14-/m0/s1
    MOLECULAR FORMULA
    C20H17FN6O2
    CROSS REFERENCES
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    canSAR1204527

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 392.14
    AlogP 2.01
    HBond donors 2
    HBond acceptors 8
    Atoms 46
    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 canSAR1204527.