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canSAR547725
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NAMES
    SMILES
    Cc1c(Cl)nc(NCCc2c[nH]cn2)c(=O)n1CC(=O)Nc1cccc(CN)c1
    InChI
    InChI=1S/C19H22ClN7O2/c1-12-17(20)26-18(23-6-5-15-9-22-11-24-15)19(29)27(12)10-16(28)25-14-4-2-3-13(7-14)8-21/h2-4,7,9,11H,5-6,8,10,21H2,1H3,(H,22,24)(H,23,26)(H,25,28)
    MOLECULAR FORMULA
    C19H22ClN7O2
    CROSS REFERENCES
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    canSAR547725

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.15
    AlogP 1.68
    HBond donors 5
    HBond acceptors 9
    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 canSAR547725.