-
1
-
-
84954323241
-
-
Eds.; Wiley: Chichester, U.K.,; pp-49
-
Vishweshwar, P.; McMahon, J. A.; Zaworotko, M. J. In Frontiers in Crystal Engineering Tiekink, E. R. T., Vittal, J. J., Eds.; Wiley: Chichester, U.K., 2006; pp 25-49.
-
(2006)
Frontiers in Crystal Engineering
, pp. 25
-
-
Vishweshwar, P.1
McMahon, J.A.2
Zaworotko, M.J.3
Tiekink, E.R.T.4
Vittal, J.J.5
-
2
-
-
0038713880
-
-
Remenar, J. F.; Morissette, S. L.; Peterson, M. L.; Moulton, B.; MacPhee, J. M.; Guzman, H. R.; Almarsson, Ö. J. Am. Chem. Soc. 2003, 125, 8456
-
(2003)
J. Am. Chem. Soc.
, vol.125
, pp. 8456
-
-
Remenar, J.F.1
Morissette, S.L.2
Peterson, M.L.3
Moulton, B.4
MacPhee, J.M.5
Guzman, H.R.6
Almarsson, Ö.7
-
3
-
-
33746899402
-
-
McNamara, D. P.; Childs, S. L.; Giordano, J.; Iarriccio, A.; Cassidy, J.; Shet, M. S.; Mannion, R.; O'Donnell, E.; Park, A. Pharm. Res. 2006, 23, 1888
-
(2006)
Pharm. Res.
, vol.23
, pp. 1888
-
-
McNamara, D.P.1
Childs, S.L.2
Giordano, J.3
Iarriccio, A.4
Cassidy, J.5
Shet, M.S.6
Mannion, R.7
O'Donnell, E.8
Park, A.9
-
4
-
-
34250862709
-
-
Hickey, M. B.; Peterson, M. L.; Scoppettuolo, L. A.; Morrisette, S. L.; Vetter, A.; Guzmán, H.; Remenar, J. F.; Zhang, Z.; Tawa, M. D.; Haley, S.; Zaworotko, M. J.; Almarsson, Ö. Eur. J. Pharm. Biopharm. 2007, 67, 112
-
(2007)
Eur. J. Pharm. Biopharm.
, vol.67
, pp. 112
-
-
Hickey, M.B.1
Peterson, M.L.2
Scoppettuolo, L.A.3
Morrisette, S.L.4
Vetter, A.5
Guzmán, H.6
Remenar, J.F.7
Zhang, Z.8
Tawa, M.D.9
Haley, S.10
Zaworotko, M.J.11
Almarsson, Ö.12
-
5
-
-
77952054009
-
-
Updated list of GRAS chemicals may be downloaded from
-
Updated list of GRAS chemicals may be downloaded from http://www.cfsan.fda.gov/dms/eafus.html.
-
-
-
-
11
-
-
53049103992
-
-
Bak, A.; Gore, A.; Yanez, E.; Stanton, M.; Tufekcic, S.; Syed, R.; Akrami, A.; Rose, M.; Surapaneni, S.; Bostick, T.; King, A.; Neervannan, S.; Ostovic, D.; Koparkar, A. J. Pharm. Sci. 2008, 97, 3942
-
(2008)
J. Pharm. Sci.
, vol.97
, pp. 3942
-
-
Bak, A.1
Gore, A.2
Yanez, E.3
Stanton, M.4
Tufekcic, S.5
Syed, R.6
Akrami, A.7
Rose, M.8
Surapaneni, S.9
Bostick, T.10
King, A.11
Neervannan, S.12
Ostovic, D.13
Koparkar, A.14
-
12
-
-
33746425242
-
-
Trask, A. V.; Sam Motherwell, W. D.; Jones, W. Int. J. Pharm. 2006, 320, 114
-
(2006)
Int. J. Pharm.
, vol.320
, pp. 114
-
-
Trask, A.V.1
Sam Motherwell, W.D.2
Jones, W.3
-
13
-
-
33846133535
-
-
Basavoju, S.; Boström, D.; Velaga, S. P. Cryst. Growth Des. 2006, 6, 2699
-
(2006)
Cryst. Growth Des.
, vol.6
, pp. 2699
-
-
Basavoju, S.1
Boström, D.2
Velaga, S.P.3
-
14
-
-
19944371772
-
-
Trask, A. V.; Motherwell, W. D. S.; Jones, W. Cryst. Growth Des. 2005, 5, 1013
-
(2005)
Cryst. Growth Des.
, vol.5
, pp. 1013
-
-
Trask, A.V.1
Motherwell, W.D.S.2
Jones, W.3
-
16
-
-
0003372555
-
-
Comprehensive Supramolecular Chemistry; Pergamon Press: Oxford, U.K.,; Vol
-
MacNicol, D. D.; Toda, F.; Bishop, R. Solid-State Supramolecular Chemistry, Crystal Engineering; Comprehensive Supramolecular Chemistry; Pergamon Press: Oxford, U.K., 1996; Vol. 6.
-
(1996)
Solid-State Supramolecular Chemistry, Crystal Engineering
, vol.6
-
-
MacNicol, D.D.1
Toda, F.2
Bishop, R.3
-
18
-
-
27744485968
-
-
Eds.; Imperial College Press: London,; pp-187
-
Nangia, A. In Nanoporous Materials: Science and Engineering; Lu, G. Q.; Zhao, X. S., Eds.; Imperial College Press: London, 2004; pp 165-187.
-
(2004)
Nanoporous Materials: Science and Engineering
, pp. 165
-
-
Nangia, A.1
Lu, G.Q.2
Zhao, X.S.3
-
19
-
-
0003730161
-
-
2 nd ed.; SSCI Inc.: West Lafayette, IN
-
Byrn, S. R.; Pfeiffer, R. R.; Stowell, J. G. Solid-State Chemistry of Drugs, 2 nd ed.; SSCI Inc.: West Lafayette, IN, 1999.
-
(1999)
Solid-State Chemistry of Drugs
-
-
Byrn, S.R.1
Pfeiffer, R.R.2
Stowell, J.G.3
-
20
-
-
65349091979
-
-
Aitipamula, S.; Chow, P. S.; Tan, R. B. H. CrystEngComm 2009, 11, 889
-
(2009)
CrystEngComm
, vol.11
, pp. 889
-
-
Aitipamula, S.1
Chow, P.S.2
Tan, R.B.H.3
-
21
-
-
70350053526
-
-
Aitipamula, S.; Chow, P. S.; Tan, R. B. H. CrystEngComm 2009, 11, 1823
-
(2009)
CrystEngComm
, vol.11
, pp. 1823
-
-
Aitipamula, S.1
Chow, P.S.2
Tan, R.B.H.3
-
22
-
-
55449117317
-
-
Braga, D.; Palladino, G.; Polito, M.; Rubini, K.; Grepioni, R.; Chierotti, M. R.; Gobetto, R. Chem.-Eur. J. 2008, 14, 10149
-
(2008)
Chem.-Eur. J.
, vol.14
, pp. 10149
-
-
Braga, D.1
Palladino, G.2
Polito, M.3
Rubini, K.4
Grepioni, R.5
Chierotti, M.R.6
Gobetto, R.7
-
23
-
-
41149108045
-
-
Sokolov, A. N.; Swenson, D. C.; MacGillivray, L. R. Proc. Natl. Acad. Sci. 2008, 105, 1794
-
(2008)
Proc. Natl. Acad. Sci.
, vol.105
, pp. 1794
-
-
Sokolov, A.N.1
Swenson, D.C.2
MacGillivray, L.R.3
-
24
-
-
49149103008
-
-
Babu, N. J.; Reddy, L. S.; Aitipamula, S.; Nangia, A. Chem. Asian J. 2008, 3, 1122
-
(2008)
Chem. Asian J.
, vol.3
, pp. 1122
-
-
Babu, N.J.1
Reddy, L.S.2
Aitipamula, S.3
Nangia, A.4
-
25
-
-
38449117939
-
-
Porter, W. W., III; Elie, S. C.; Matzger, A. J. Cryst. Growth Des. 2008, 8, 14
-
(2008)
Cryst. Growth Des.
, vol.8
, pp. 14
-
-
Iii, W.P.W.1
Elie, S.C.2
Matzger, A.J.3
-
28
-
-
26444620704
-
-
Vishweshwar, P.; McMahon, J. A.; Peterson, M. L.; Hickey, M. B.; Shattock, T. R.; Zaworotko, M. J. Chem. Commun. 2005, 4601
-
(2005)
Chem. Commun.
, pp. 4601
-
-
Vishweshwar, P.1
McMahon, J.A.2
Peterson, M.L.3
Hickey, M.B.4
Shattock, T.R.5
Zaworotko, M.J.6
-
29
-
-
60849119998
-
-
Friš̌cÌŒić, T.; Trask, A. V.; Motherwell, W. D. S.; Jones, W. Cryst. Growth Des. 2008, 8, 1605
-
(2008)
Cryst. Growth Des.
, vol.8
, pp. 1605
-
-
FrisìŒìŒcìŒić, T.1
Trask, A.V.2
Motherwell, W.D.S.3
Jones, W.4
-
30
-
-
33745697786
-
-
Banerjee, R.; Bhatt, P. M.; Desiraju, G. R. Cryst. Growth Des. 2006, 6, 1468
-
(2006)
Cryst. Growth Des.
, vol.6
, pp. 1468
-
-
Banerjee, R.1
Bhatt, P.M.2
Desiraju, G.R.3
-
31
-
-
25444484704
-
-
Bhogala, B. R.; Basavoju, S.; Nangia, A. Cryst. Growth Des. 2005, 5, 1683
-
(2005)
Cryst. Growth Des.
, vol.5
, pp. 1683
-
-
Bhogala, B.R.1
Basavoju, S.2
Nangia, A.3
-
32
-
-
33749844046
-
-
Thallapally, P. K.; Dobrzaśska, L.; Gingrich, T. R.; Wirsig, T. B.; Barbour, L. J.; Atwood, J. L. Angew. Chem., Int. Ed. 2006, 45, 6506
-
(2006)
Angew. Chem., Int. Ed.
, vol.45
, pp. 6506
-
-
Thallapally, P.K.1
Dobrzaśska, L.2
Gingrich, T.R.3
Wirsig, T.B.4
Barbour, L.J.5
Atwood, J.L.6
-
33
-
-
0036829138
-
-
Atwood, J. L.; Barbour, L. J.; Jerga, A.; Schottel, B. L. Science 2002, 298, 1000
-
(2002)
Science
, vol.298
, pp. 1000
-
-
Atwood, J.L.1
Barbour, L.J.2
Jerga, A.3
Schottel, B.L.4
-
34
-
-
34250864401
-
-
Karki, S.; FrisÌŒcÌŒić, T.; Jones, W.; Motherwell, W. D. S. Mol. Pharm. 2007, 4, 347
-
(2007)
Mol. Pharm.
, vol.4
, pp. 347
-
-
Karki, S.1
FrisìŒcìŒić, T.2
Jones, W.3
Motherwell, W.D.S.4
-
36
-
-
0033956402
-
-
Aoki, S.; Mizutani, T.; Danjo, D. Chem. Pharm. Bull. 2000, 48, 140
-
(2000)
Chem. Pharm. Bull.
, vol.48
, pp. 140
-
-
Aoki, S.1
Mizutani, T.2
Danjo, D.3
-
37
-
-
0018242597
-
-
Kawano, O.; Sawabe, T.; Misaki, N.; Fukawa, K. Jpn. J. Pharmacol. 1978, 28, 829
-
(1978)
Jpn. J. Pharmacol.
, vol.28
, pp. 829
-
-
Kawano, O.1
Sawabe, T.2
Misaki, N.3
Fukawa, K.4
-
38
-
-
16544369315
-
-
Moribe, K.; Tsuchiya, M.; Tozuka, Y.; Yamaguchi, K.; Oguchi, T.; Yamamoto, K. Chem. Pharm. Bull. 2004, 52, 524
-
(2004)
Chem. Pharm. Bull.
, vol.52
, pp. 524
-
-
Moribe, K.1
Tsuchiya, M.2
Tozuka, Y.3
Yamaguchi, K.4
Oguchi, T.5
Yamamoto, K.6
-
39
-
-
70449345812
-
-
Pagola, S.; Stephens, P. W. Acta Crystallogr., Sect. C 2009, 65, o583
-
(2009)
Acta Crystallogr., Sect. C
, vol.65
, pp. 583
-
-
Pagola, S.1
Stephens, P.W.2
-
40
-
-
77952077902
-
-
May 2009 update; Cambridge Crystallographic Data Centre, Cambridge. U.K.,; to be found under
-
Cambridge Structural Database (version 5.29) ConQuest 1.10, May 2009 update; Cambridge Crystallographic Data Centre, Cambridge. U.K., 2007; to be found under www.ccdc.cam.ac.uk.
-
(2007)
Cambridge Structural Database (Version 5.29) ConQuest 1.10
-
-
-
42
-
-
77952038457
-
-
It should be mentioned here that the CSD does not contain information pertaining to pharmaceutical relevance of many cocrystal components, and it is often difficult to judge whether a particular compound is pharmaceutically relevant or not just based on its compound name. Hence, our estimation of pharmaceutical cocrystals is based on a general search of all these compounds, and it is possible that the actual number of pharmaceutical cocrystals could be more than 137 of the total 3624 cocrystals
-
It should be mentioned here that the CSD does not contain information pertaining to pharmaceutical relevance of many cocrystal components, and it is often difficult to judge whether a particular compound is pharmaceutically relevant or not just based on its compound name. Hence, our estimation of pharmaceutical cocrystals is based on a general search of all these compounds, and it is possible that the actual number of pharmaceutical cocrystals could be more than 137 of the total 3624 cocrystals.
-
-
-
-
44
-
-
77952071864
-
-
Computed in Materials Studio using Forcite module, COMPAS force field
-
Computed in Materials Studio using Forcite module, COMPAS force field. www.accelrys.com.
-
-
-
-
46
-
-
0037878049
-
-
Jetti, R. K. R.; Boese, R.; Sarma, J. A. R. P.; Reddy, L. S.; Vishweshwar, P.; Desiraju, G. R. Angew. Chem., Int. Ed. 2003, 42, 1963
-
(2003)
Angew. Chem., Int. Ed.
, vol.42
, pp. 1963
-
-
Jetti, R.K.R.1
Boese, R.2
Sarma, J.A.R.P.3
Reddy, L.S.4
Vishweshwar, P.5
Desiraju, G.R.6
-
48
-
-
0141627908
-
-
Vishweshwar, P.; Nangia, A.; Lynch, V. M. Cryst. Growth Des. 2003, 3, 783
-
(2003)
Cryst. Growth Des.
, vol.3
, pp. 783
-
-
Vishweshwar, P.1
Nangia, A.2
Lynch, V.M.3
-
49
-
-
17144427711
-
-
McMahon, J. A.; Bis, J. A.; Vishweshwar, P.; Shattock, T. R.; McLaughlin, O. L.; Zaworotko, M. J. Z. Kristallogr. 2005, 220, 340
-
(2005)
Z. Kristallogr.
, vol.220
, pp. 340
-
-
McMahon, J.A.1
Bis, J.A.2
Vishweshwar, P.3
Shattock, T.R.4
McLaughlin, O.L.5
Zaworotko, M.J.6
-
50
-
-
0001766774
-
-
Eds.; Elsevier Science: Oxford, U.K.,; Vol., pp-850
-
Caira, M. R.; Nassimbeni, L. R. Comprehensive Supramolecular Chemistry; Atwood, J. L.; Davies, J. E. D.; MacNicol, D.; Vögtle, F., Eds.; Elsevier Science: Oxford, U.K., 1996; Vol. 6, pp 825-850.
-
(1996)
Comprehensive Supramolecular Chemistry
, vol.6
, pp. 825
-
-
Caira, M.R.1
Nassimbeni, L.R.2
Atwood, J.L.3
Davies, J.E.D.4
MacNicol, D.5
Vögtle, F.6
-
51
-
-
60849111591
-
-
Etter, M. C.; Frankenbach, G. M.; Adsmond, D. A. Mol. Cryst. Liq. Cryst. 1990, 187, 285
-
(1990)
Mol. Cryst. Liq. Cryst.
, vol.187
, pp. 285
-
-
Etter, M.C.1
Frankenbach, G.M.2
Adsmond, D.A.3
-
52
-
-
33644942719
-
-
Sokolov, A. N.; Friščič, T.; MacGillivray, L. R. J. Am. Chem. Soc. 2006, 128, 2806
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 2806
-
-
Sokolov, A.N.1
FrisìŒcìŒicìŒ, T.2
MacGillivray, L.R.3
-
53
-
-
40549097743
-
-
MacGillivray, L. R.; Papaefstathiou, G. S.; FrisÌŒcÌ Œić, T.; Hamilton, T. D.; BucÌŒar, D.-K.; Chu, Q.; Varshney, D. B.; Georgiev, I. G. Acc. Chem. Res. 2008, 41, 280
-
(2008)
Acc. Chem. Res.
, vol.41
, pp. 280
-
-
MacGillivray, L.R.1
Papaefstathiou, G.S.2
FrisìŒcìŒ ić, T.3
Hamilton, T.D.4
BucìŒar, D.-K.5
Chu, Q.6
Varshney, D.B.7
Georgiev, I.G.8
-
54
-
-
0000776859
-
-
Eds.; Wiley Interscience: New York,; Vol., pp-767
-
McCrone, W. C. In Polymorphism in Physics and Chemistry of the Organic Solid State; Fox, D.; Labes, M. M.; Weissberger, A., Eds.; Wiley Interscience: New York, 1965; Vol. 2, pp 725-767.
-
(1965)
Polymorphism in Physics and Chemistry of the Organic Solid State
, vol.2
, pp. 725
-
-
McCrone, W.C.1
Fox, D.2
Labes, M.M.3
Weissberger, A.4
-
57
-
-
56549089449
-
-
Brychczynska, M.; Davey, R. J.; Pidcock, E. New J. Chem. 2008, 32, 1754
-
(2008)
New J. Chem.
, vol.32
, pp. 1754
-
-
Brychczynska, M.1
Davey, R.J.2
Pidcock, E.3
-
59
-
-
0040601673
-
-
Görbitz, C. H.; Hersleth, H.-P. Acta Crystallogr., Sect. B 2000, 56, 526
-
(2000)
Acta Crystallogr., Sect. B
, vol.56
, pp. 526
-
-
Görbitz, C.H.1
Hersleth, H.-P.2
-
61
-
-
0141739795
-
-
Gillon, A. L.; Feeder, N.; Davey, R. J.; Storey, R. Cryst. Growth Des. 2003, 3, 663
-
(2003)
Cryst. Growth Des.
, vol.3
, pp. 663
-
-
Gillon, A.L.1
Feeder, N.2
Davey, R.J.3
Storey, R.4
-
63
-
-
2542569909
-
-
Infantes, L.; Chisholm, J.; Motherwell, S. CrystEngComm 2003, 5, 480
-
(2003)
CrystEngComm
, vol.5
, pp. 480
-
-
Infantes, L.1
Chisholm, J.2
Motherwell, S.3
-
64
-
-
33847016492
-
-
Infantes, L.; Fábián, L.; Motherwell, W. D. S. CrystEngComm 2007, 9, 65
-
(2007)
CrystEngComm
, vol.9
, pp. 65
-
-
Infantes, L.1
Fábián, L.2
Motherwell, W.D.S.3
-
65
-
-
27944487022
-
-
As part of an analysis of the occurrence of pharmaceutically acceptable anions and cations in the CSD, Haynes et al. retrieved the hydrates of cocrystals that contain at least one pharmaceutically acceptable acid or base. It was found that, of the 381 total cocrystals, 59 (15.5%) were hydrates. See
-
As part of an analysis of the occurrence of pharmaceutically acceptable anions and cations in the CSD, Haynes et al. retrieved the hydrates of cocrystals that contain at least one pharmaceutically acceptable acid or base. It was found that, of the 381 total cocrystals, 59 (15.5%) were hydrates. See Haynes, D. A.; Jones, W.; Motherwell, W. D. S. J. Pharm. Sci. 2005, 94, 2111
-
(2005)
J. Pharm. Sci.
, vol.94
, pp. 2111
-
-
Haynes, D.A.1
Jones, W.2
Motherwell, W.D.S.3
-
66
-
-
77952087116
-
-
note
-
2+, COOÂ etc., significantly increases the chances of forming hydrates (see refs 63 and 65).
-
-
-
|