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Borchardt, R.T.2
Rafferty, M.F.3
Krass, P.4
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48
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0017750409
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Binding characteristics of a radiolabeled agonist and antagonist at central nervous system Alpha noradrenergic receptors
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U'Prichard, D. C.; Greenberg, D. A.; Snyder, S. H. Binding Characteristics of a Radiolabeled Agonist and Antagonist at Central Nervous System Alpha Noradrenergic Receptors. Mol. Pharmacol. 1977, 13, 454-473.
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U'Prichard, D.C.1
Greenberg, D.A.2
Snyder, S.H.3
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49
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0029795609
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Effect of ring size or an additional heteroatom on the potency and selectivity of bicyclic benzylamine-type inhibitors of phenylethanolamine N-methyltransferase
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Grunewald, G. L.; Dahanukar, V. H.; Ching, P.; Criscione, K. R. Effect of Ring Size or an Additional Heteroatom on the Potency and Selectivity of Bicyclic Benzylamine-type Inhibitors of Phenylethanolamine N-Methyltransferase. J. Med. Chem. 1996, 39, 3539-3546.
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Grunewald, G.L.1
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Criscione, K.R.4
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50
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0004821404
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Approaches to the design of selective inhibitors of phenylethanolamine N-methyltransferase: Development of an active site model
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Stolk, J. M., U'Prichard, D. C., Fuxe, K., Eds.; Oxford: New York
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Grunewald, G. L.; Monn, J. A.; Sall, D. J. Approaches to the Design of Selective Inhibitors of Phenylethanolamine N-Methyltransferase: Development of an Active Site Model. In Epinephrine in the Central Nervous System; Stolk, J. M., U'Prichard, D. C., Fuxe, K., Eds.; Oxford: New York, 1988; pp 117-140.
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Grunewald, G.L.1
Monn, J.A.2
Sall, D.J.3
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51
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0344328291
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note
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As will be noted later in the CoMFA section, the best CoMFA models were obtained by using the parameters for the neutral forms of compounds 13 and 14. However, in the QSAR, the r values showed significant reduction if the neutral forms were used (eq 1, r = 0.853 vs r = 0.730 if neutral forms used; eq 3, r = 0.826 vs r = 0.800 if neutral forms used).
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52
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0344760305
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note
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5.
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54
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0003452899
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American Chemical Society: Salem, MA
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Hansch, C.; Leo, A. J.; Hoekman, D. In Exploring QSAR. Hydrophobic, Electronic and Steric Constants; American Chemical Society: Salem, MA, 1995.
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(1995)
Exploring QSAR. Hydrophobic, Electronic and Steric Constants
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Hansch, C.1
Leo, A.J.2
Hoekman, D.3
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56
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0344760301
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note
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2-adrenoceptor equation (eq 4) did not increase the correlation (0.917 vs 0.917) and was therefore not included in the derivation.
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57
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0345190701
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note
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(1,26,0.01) = 7.72]. This equation explains only 24% of the variance in the data and would indicate that both sites cannot be described by a single equation.
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58
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0345190702
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note
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This suggests that the use of the flipped orientation might have been of value in the QSAR analyses. However, there is only one such compound in the data set, and using an indicator variable for it would be of limited usefulness in the QSAR analyses.
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59
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0002714675
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Rapid chromatographic technique for preparative separations with moderate resolution
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Still, W. C.; Mitra A.; Kahn, M. Rapid Chromatographic Technique for Preparative Separations with Moderate Resolution. J. Org. Chem. 1978, 43, 2923-2924.
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(1978)
J. Org. Chem.
, vol.43
, pp. 2923-2924
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Still, W.C.1
Mitra, A.2
Kahn, M.3
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60
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0023886410
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Synthesis and evaluation of 3-substituted analogues of 1,2,3,4-tetrahydroisoquinoline as inhibitors of phenylethanolamine N-methyltransferase
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Grunewald, G. L.; Sall, D. J.; Monn, J. A. Synthesis and Evaluation of 3-Substituted Analogues of 1,2,3,4-Tetrahydroisoquinoline as Inhibitors of Phenylethanolamine N-Methyltransferase. J. Med. Chem. 1988, 31, 824-830.
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(1988)
J. Med. Chem.
, vol.31
, pp. 824-830
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Grunewald, G.L.1
Sall, D.J.2
Monn, J.A.3
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