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canSAR1588418
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NAMES
    SMILES
    N#CC(Cc1ccc(-c2ncc(Cl)cn2)cc1F)NC(=O)[C@H]1N[C@@H]2CC[C@H]1C2
    InChI
    InChI=1S/C20H19ClFN5O/c21-14-9-24-19(25-10-14)13-2-1-11(17(22)7-13)5-16(8-23)27-20(28)18-12-3-4-15(6-12)26-18/h1-2,7,9-10,12,15-16,18,26H,3-6H2,(H,27,28)/t12-,15+,16?,18-/m0/s1
    MOLECULAR FORMULA
    C20H19ClFN5O
    CROSS REFERENCES
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    canSAR1588418

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.13
    AlogP 2.63
    HBond donors 2
    HBond acceptors 6
    Atoms 47
    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 canSAR1588418.