Crystallography Open Database
Search results
Result: there are 136 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'MedChemComm'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7112106 | CIF | C18 H18 Br N O2 | P 21 21 21 | 5.975; 11.69; 23.785 90; 90; 90 | 1661.33 | McCoull, William; Augustin, Martin; Blake, Caroline; Ertan, Anne; Kilgour, Elaine; Krapp, Stephan; Moore, Jane E.; Newcombe, Nicholas J.; Packer, Martin J.; Rees, Amanda; Revill, John; Scott, James S.; Selmi, Nidhal; Gerhardt, Stefan; Ogg, Derek J.; Steinbacher, Stefan; Whittamore, Paul R. O. Identification and optimisation of 3,3-dimethyl-azetidin-2-ones as potent and selective inhibitors of 11β-hydroxysteroid dehydrogenase type 1 (11β-HSD1) MedChemComm, 2014, 5, 57 |
| 7112497 | CIF | C24 H34 Cu2 N2 O10 | P 21 21 21 | 12.104; 16.437; 27.634 90; 90; 90 | 5498 | Arjmand, Farukh; Muddassir, Mohd; Zaidi, Yusra; Ray, Debashis Design, synthesis and crystal structure determination of dinuclear copper-based potential chemotherapeutic drug entities; in vitro DNA binding, cleavage studies and an evaluation of genotoxicity by micronucleus test and comet assay MedChemComm, 2013, 4, 394 |
| 7112498 | CIF | C15 H21 Cl N2 O3 | P 1 21/n 1 | 5.4814; 15.0113; 18.9143 90; 90.881; 90 | 1556.14 | Cojocaru, O. Andreea; Bica, Katharina; Gurau, Gabriela; Narita, Asako; McCrary, Parker D.; Shamshina, Julia L.; Barber, Patrick S.; Rogers, Robin D. Prodrug ionic liquids: functionalizing neutral active pharmaceutical ingredients to take advantage of the ionic liquid form MedChemComm, 2013, 4, 559 |
| 7112499 | CIF | C22 H37 Cl N O3 P | P 1 21/n 1 | 9.5949; 14.3513; 17.5913 90; 102.694; 90 | 2363.1 | Cojocaru, O. Andreea; Bica, Katharina; Gurau, Gabriela; Narita, Asako; McCrary, Parker D.; Shamshina, Julia L.; Barber, Patrick S.; Rogers, Robin D. Prodrug ionic liquids: functionalizing neutral active pharmaceutical ingredients to take advantage of the ionic liquid form MedChemComm, 2013, 4, 559 |
| 7112500 | CIF | C15 H14 N4 S | P 1 21/n 1 | 9.795; 14.728; 10.036 90; 107.768; 90 | 1378.74 | Ciupa, Alexander; De Bank, Paul A.; Mahon, Mary F.; Wood, Pauline J.; Caggiano, Lorenzo Synthesis and antiproliferative activity of some 3-(pyrid-2-yl)-pyrazolines MedChemComm, 2013, 4, 956 |
| 7112501 | CIF | C24 H23 N3 O4 | P b c a | 6.977; 22.095; 26.601 90; 90; 90 | 4100.73 | Ciupa, Alexander; De Bank, Paul A.; Mahon, Mary F.; Wood, Pauline J.; Caggiano, Lorenzo Synthesis and antiproliferative activity of some 3-(pyrid-2-yl)-pyrazolines MedChemComm, 2013, 4, 956 |
| 7112502 | CIF | C26 H27 Au N2 O S | P -1 | 9.77; 9.7877; 12.2436 88.65; 87.135; 75.316 | 1131.08 | Rubbiani, Riccardo; Schuh, Esther; Meyer, Andreas; Lemke, Jessika; Wimberg, Jan; Metzler-Nolte, Nils; Meyer, Franc; Mohr, Fabian; Ott, Ingo TrxR inhibition and antiproliferative activities of structurally diverse gold N-heterocyclic carbene complexes MedChemComm, 2013, 4, 942 |
| 7112503 | CIF | C13 H21 Cl2 N3 O4 | P -1 | 7.2598; 10.0853; 12.2011 101.01; 93.643; 100.482 | 857.77 | Genest, David; Rochais, Christophe; Lecoutey, Cédric; Oliveira Santos, Jana Sopkova-de; Ballandonne, Céline; Butt-Gueulle, Sabrina; Legay, Remi; Since, Marc; Dallemagne, Patrick Design, synthesis and biological evaluation of novel indano- and thiaindano-pyrazoles with potential interest for Alzheimer's disease MedChemComm, 2013, 4, 925 |
| 7112504 | CIF | C12 H11 F3 N2 O2 S | P 1 21/c 1 | 6.7601; 8.9249; 22.5441 90; 97.265; 90 | 1349.24 | Genest, David; Rochais, Christophe; Lecoutey, Cédric; Oliveira Santos, Jana Sopkova-de; Ballandonne, Céline; Butt-Gueulle, Sabrina; Legay, Remi; Since, Marc; Dallemagne, Patrick Design, synthesis and biological evaluation of novel indano- and thiaindano-pyrazoles with potential interest for Alzheimer's disease MedChemComm, 2013, 4, 925 |
| 7112505 | CIF | C22 H34 N O6 Si | C 1 2 1 | 23.812; 6.666; 18.297 90; 123.79; 90 | 2413.7 | Wang, Jen-Tsung; Lin, Ting-Chien; Chen, Ying-Hsuan; Lin, Chun-Hung; Fang, Jim-Min Polyhydroxylated pyrrolidine and 2-oxapyrrolizidine as glycosidase inhibitors MedChemComm, 2013, 4, 783 |
| 7112506 | CIF | C14 H15 Cl N2 O | P 21 21 21 | 7.929; 12.53; 12.977 90; 90; 90 | 1289.3 | Masciocchi, Daniela; Gelain, Arianna; Porta, Federica; Meneghetti, Fiorella; Pedretti, Alessandro; Celentano, Giuseppe; Barlocco, Daniela; Legnani, Laura; Toma, Lucio; Kwon, Byoung-Mog; Asai, Akira; Villa, Stefania Synthesis, structure‒activity relationships and stereochemical investigations of new tricyclic pyridazinone derivatives as potential STAT3 inhibitors MedChemComm, 2013, 4, 1181 |
| 7112507 | CIF | C37 H43 Cl O17 | P 1 21 1 | 16.0735; 7.0772; 18.7585 90; 113.351; 90 | 1959.1 | Mascitti, Vincent; Thuma, Benjamin A.; Smith, Aaron C.; Robinson, Ralph P.; Brandt, Thomas; Kalgutkar, Amit S.; Maurer, Tristan S.; Samas, Brian; Sharma, Raman On the importance of synthetic organic chemistry in drug discovery: reflections on the discovery of antidiabetic agent ertugliflozin MedChemComm, 2013, 4, 101 |
| 7112508 | CIF | C20 H24 N2 O6 | P 1 21/n 1 | 12.3996; 8.7715; 18.6699 90; 104.088; 90 | 1969.52 | Schmid, Fabian; Jessen, Henning J.; Burch, Patrick; Gademann, Karl Truncated militarinone fragments identified by total chemical synthesis induce neurite outgrowth MedChemComm, 2013, 4, 135 |
| 7112509 | CIF | C16 H17 N O5 | P -1 | 7.2983; 9.2081; 12.3051 107.988; 96.327; 107.403 | 731.59 | Schmid, Fabian; Jessen, Henning J.; Burch, Patrick; Gademann, Karl Truncated militarinone fragments identified by total chemical synthesis induce neurite outgrowth MedChemComm, 2013, 4, 135 |
| 7112510 | CIF | C16 H17 N O5 | P 1 21/c 1 | 11.3216; 7.0251; 18.4969 90; 92.747; 90 | 1469.47 | Schmid, Fabian; Jessen, Henning J.; Burch, Patrick; Gademann, Karl Truncated militarinone fragments identified by total chemical synthesis induce neurite outgrowth MedChemComm, 2013, 4, 135 |
| 7112511 | CIF | C25 H25 F3 N4 O6 | P -1 | 5.1885; 11.4587; 21.469 75.373; 86.058; 83.124 | 1225.2 | Plowright, Alleyn T.; Barton, Peter; Bennett, Stuart; Birch, Alan M.; Birtles, Susan; Buckett, Linda K.; Butlin, Roger J.; Davies, Robert D. M.; Ertan, Anne; Gutierrez, Pablo Morentin; Kemmitt, Paul D.; Leach, Andrew G.; Svensson, Per H.; Turnbull, Andrew V.; Waring, Michael J. Design and synthesis of a novel series of cyclohexyloxy-pyridyl derivatives as inhibitors of diacylglycerol acyl transferase 1 MedChemComm, 2013, 4, 151 |
| 7112512 | CIF | C21 H17 F4 N5 O5 | C 1 2/c 1 | 29.7773; 6.32; 23.2587 90; 100.671; 90 | 4301.4 | Plowright, Alleyn T.; Barton, Peter; Bennett, Stuart; Birch, Alan M.; Birtles, Susan; Buckett, Linda K.; Butlin, Roger J.; Davies, Robert D. M.; Ertan, Anne; Gutierrez, Pablo Morentin; Kemmitt, Paul D.; Leach, Andrew G.; Svensson, Per H.; Turnbull, Andrew V.; Waring, Michael J. Design and synthesis of a novel series of cyclohexyloxy-pyridyl derivatives as inhibitors of diacylglycerol acyl transferase 1 MedChemComm, 2013, 4, 151 |
| 7112513 | CIF | C20 H22 N6 O4 | P -1 | 5.2885; 11.2227; 16.881 85.165; 83.895; 76.853 | 968.2 | Scott, James S.; Birch, Alan M.; Brocklehurst, Katy J.; Brown, Hayley S.; Goldberg, Kristin; Groombridge, Sam D.; Hudson, Julian A.; Leach, Andrew G.; MacFaul, Philip A.; McKerrecher, Darren; Poultney, Ruth; Schofield, Paul; Svensson, Per H. Optimisation of aqueous solubility in a series of G protein coupled receptor 119 (GPR119) agonists MedChemComm, 2013, 4, 95 |
| 7112563 | CIF | C19 H17 N3 O3 | P 1 21/c 1 | 16.266; 11.114; 9.8401 90; 101.629; 90 | 1742.4 | Ongarora, Benson G.; Hu, Xiaoke; Li, Hairong; Fronczek, Frank R.; Vicente, M Graça H Syntheses and properties of trimethylaminophenoxy-substituted Zn((II))-phthalocyanines. MedChemComm, 2012, 3, 179-194 |
| 7112564 | CIF | C19 H17 N3 O3 | P c a 21 | 10.139; 8.597; 20.157 90; 90; 90 | 1757 | Ongarora, Benson G.; Hu, Xiaoke; Li, Hairong; Fronczek, Frank R.; Vicente, M Graça H Syntheses and properties of trimethylaminophenoxy-substituted Zn((II))-phthalocyanines. MedChemComm, 2012, 3, 179-194 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!