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Structure paper

TitleInvestigation of the pyrazinones as PDE5 inhibitors: Evaluation of regioisomeric projections into the solvent region.
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 21, Page 6348-6352, Year 2011
Publish dateAug 17, 2011 (structure data deposition date)
AuthorsHughes, R.O. / Maddux, T. / Joseph Rogier, D. / Lu, S. / Walker, J.K. / Jon Jacobsen, E. / Rumsey, J.M. / Zheng, Y. / Macinnes, A. / Bond, B.R. / Han, S.
External linksBioorg. Med. Chem. Lett. / PubMed:21955943
MethodsX-ray diffraction
Resolution1.91 - 1.96 Å
Structure data

PDB-3tge:
A novel series of potent and selective PDE5 inhibitor1
Method: X-RAY DIFFRACTION / Resolution: 1.96 Å

PDB-3tgg:
A novel series of potent and selective PDE5 inhibitor2
Method: X-RAY DIFFRACTION / Resolution: 1.91 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry

ChemComp-TGE:
7-(6-methoxypyridin-3-yl)-3-{[2-(morpholin-4-yl)ethyl]amino}-1-(2-propoxyethyl)pyrido[3,4-b]pyrazin-2(1H)-one

ChemComp-HOH:
WATER

ChemComp-0H3:
7-(6-methoxypyridin-3-yl)-4-{[2-(propan-2-yloxy)ethyl]amino}-1-(2-propoxyethyl)pyrido[4,3-d]pyrimidin-2(1H)-one

Source
  • homo sapiens (human)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / HYDROLASE-HYDROLASE INHIBITOR complex / phosphodiesterase / HYDROLASE

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