Citation | Zhang, W; Zhang, D; Stashko, MA; DeRyckere, D; Hunter, D; Kireev, D; Miley, MJ; Cummings, C; Lee, M; Norris-Drouin, J; Stewart, WM; Sather, S; Zhou, Y; Kirkpatrick, G; Machius, M; Janzen, WP; Earp, HS; Graham, DK; Frye, SV; Wang, X Pseudo-cyclization through intramolecular hydrogen bond enables discovery of pyridine substituted pyrimidines as new Mer kinase inhibitors. J Med Chem56:9683-92 (2014) [PubMed] Article |
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SMILES | CCCCNc1ncc(c(N[C@H]2CC[C@H](CN)CC2)n1)-c1ccccn1 |r,wU:11.10,wD:14.14,(31.68,-9.79,;33.01,-9.02,;34.35,-9.79,;35.68,-9.02,;37.01,-9.8,;38.35,-9.03,;39.68,-9.8,;41.02,-9.03,;41.01,-7.48,;39.68,-6.71,;39.67,-5.17,;38.34,-4.41,;37.01,-5.18,;35.67,-4.4,;35.67,-2.86,;34.34,-2.09,;34.34,-.55,;37.01,-2.09,;38.34,-2.86,;38.35,-7.48,;42.34,-6.7,;43.68,-7.47,;45,-6.7,;45,-5.16,;43.65,-4.39,;42.34,-5.16,)| |