{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,10]],"date-time":"2025-10-10T18:44:39Z","timestamp":1760121879751},"reference-count":29,"publisher":"American Chemical Society (ACS)","issue":"7","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2010,7,26]]},"DOI":"10.1021\/ci1000828","type":"journal-article","created":{"date-parts":[[2010,7,1]],"date-time":"2010-07-01T17:08:49Z","timestamp":1278004129000},"page":"1275-1283","source":"Crossref","is-referenced-by-count":18,"title":["A General Treatment of Solubility 4. Description and Analysis of a PCA Model for Ostwald Solubility Coefficients"],"prefix":"10.1021","volume":"50","author":[{"given":"Indrek","family":"Tulp","sequence":"first","affiliation":[{"name":"Institute of Chemistry, University of Tartu, 14A Ravila, Tartu 50411, Estonia, Center for Heterocyclic Compounds, Department of Chemistry, University of Florida, Gainesville, Florida, 32611, Department of Chemistry, Tallinn University of Technology, Akadeemia tee 15, Tallinn 12618, Estonia, and Department of Chemistry, University of North Texas, Denton, Texas 76203-5070"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Dimitar A.","family":"Dobchev","sequence":"additional","affiliation":[{"name":"Institute of Chemistry, University of Tartu, 14A Ravila, Tartu 50411, Estonia, Center for Heterocyclic Compounds, Department of Chemistry, University of Florida, Gainesville, Florida, 32611, Department of Chemistry, Tallinn University of Technology, Akadeemia tee 15, Tallinn 12618, Estonia, and Department of Chemistry, University of North Texas, Denton, Texas 76203-5070"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Alan R.","family":"Katritzky","sequence":"additional","affiliation":[{"name":"Institute of Chemistry, University of Tartu, 14A Ravila, Tartu 50411, Estonia, Center for Heterocyclic Compounds, Department of Chemistry, University of Florida, Gainesville, Florida, 32611, Department of Chemistry, Tallinn University of Technology, Akadeemia tee 15, Tallinn 12618, Estonia, and Department of Chemistry, University of North Texas, Denton, Texas 76203-5070"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"suffix":"Jr.","given":"William","family":"Acree","sequence":"additional","affiliation":[{"name":"Institute of Chemistry, University of Tartu, 14A Ravila, Tartu 50411, Estonia, Center for Heterocyclic Compounds, Department of Chemistry, University of Florida, Gainesville, Florida, 32611, Department of Chemistry, Tallinn University of Technology, Akadeemia tee 15, Tallinn 12618, Estonia, and Department of Chemistry, University of North Texas, Denton, Texas 76203-5070"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Uko","family":"Maran","sequence":"additional","affiliation":[{"name":"Institute of Chemistry, University of Tartu, 14A Ravila, Tartu 50411, Estonia, Center for Heterocyclic Compounds, Department of Chemistry, University of Florida, Gainesville, Florida, 32611, Department of Chemistry, Tallinn University of Technology, Akadeemia tee 15, Tallinn 12618, Estonia, and Department of Chemistry, University of North Texas, Denton, Texas 76203-5070"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2010,7,1]]},"reference":[{"key":"ref1\/cit1","volume-title":"Solvents and Solvent Effects in Organic Chemistry","author":"Reichardt C.","year":"2003","edition":"3"},{"key":"ref2\/cit2","doi-asserted-by":"crossref","first-page":"31","DOI":"10.1517\/17460441.1.1.31","volume":"1","author":"Dearden J. C.","year":"2006","journal-title":"Expert Opin. Drug Discovery"},{"key":"ref3\/cit3","doi-asserted-by":"crossref","first-page":"1289","DOI":"10.1021\/ci800058v","volume":"48","author":"Llin\u00e1s A.","year":"2008","journal-title":"J. Chem. Inf. Model."},{"key":"ref4\/cit4","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1021\/ci800436c","volume":"49","author":"Hopfinger A. J.","year":"2009","journal-title":"J. Chem. Inf. Model."},{"key":"ref5\/cit5","doi-asserted-by":"crossref","first-page":"571","DOI":"10.1021\/ci800406y","volume":"49","author":"Wang J. M.","year":"2009","journal-title":"J. Chem. Inf. Model."},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"2572","DOI":"10.1021\/ci900286s","volume":"49","author":"Hewitt M.","year":"2009","journal-title":"J. Chem. Inf. Model."},{"key":"ref7\/cit7","doi-asserted-by":"crossref","first-page":"1794","DOI":"10.1021\/ci034120c","volume":"43","author":"Katritzky A. R.","year":"2003","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ref8\/cit8","doi-asserted-by":"crossref","first-page":"1806","DOI":"10.1021\/ci034122x","volume":"43","author":"Katritzky A. R.","year":"2003","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ref9\/cit9","doi-asserted-by":"crossref","first-page":"913","DOI":"10.1021\/ci0496189","volume":"45","author":"Katritzky A. R.","year":"2005","journal-title":"J. Chem. Inf. Model."},{"key":"ref10\/cit10","doi-asserted-by":"crossref","first-page":"2027","DOI":"10.1021\/cr00031a013","volume":"94","author":"Tomasi J.","year":"1994","journal-title":"Chem. Rev."},{"key":"ref11\/cit11","doi-asserted-by":"crossref","first-page":"141","DOI":"10.1016\/S0065-3276(08)60212-9","volume":"28","author":"Karelson M.","year":"1997","journal-title":"Adv. Quantum Chem."},{"key":"ref12\/cit12","doi-asserted-by":"crossref","first-page":"143","DOI":"10.1016\/j.chroma.2006.06.074","volume":"1","author":"Vitha M.","year":"2006","journal-title":"J. Chromatogr., A"},{"key":"ref13\/cit13","first-page":"183","volume-title":"Applications of Electrostatic-Covalent Models in Chemistry","author":"Drago R. S.","year":"1994"},{"key":"ref14\/cit14","doi-asserted-by":"crossref","first-page":"413","DOI":"10.1002\/cphc.200400337","volume":"6","author":"Dutt G. B.","year":"2005","journal-title":"Chem. Phys. Chem."},{"key":"ref15\/cit15","doi-asserted-by":"crossref","first-page":"565","DOI":"10.1021\/ar010054t","volume":"35","author":"Desiraju G. R.","year":"2002","journal-title":"Acc. Chem. Res."},{"key":"ref16\/cit16","doi-asserted-by":"crossref","first-page":"69","DOI":"10.1016\/j.csda.2003.11.027","volume":"48","author":"Kettaneh N.","year":"2005","journal-title":"Comput. Stat. Data Anal."},{"key":"ref17\/cit17","doi-asserted-by":"crossref","first-page":"419","DOI":"10.1007\/s00216-004-2783-y","volume":"380","author":"Eriksson L.","year":"2004","journal-title":"Anal. Bioanal. Chem."},{"key":"ref18\/cit18","unstructured":"SIMCA-P, version 11.5;Umetrics AB:Ume\u00e5, Sweden, 2008."},{"key":"ref19\/cit19","first-page":"177","volume-title":"In Applied Multivariate Statistical Analysis","author":"Johnson R. A.","year":"1982"},{"key":"ref20\/cit20","unstructured":"Eriksson, L.; Johansson, E.; Kettaneh-Wold, N.; Wold, S. PCA.InMulti- and Megavariate Data Analysis,Umetrics AB,Ume\u00e5, Sweden, 2001; pp43\u221269."},{"key":"ref21\/cit21","doi-asserted-by":"crossref","first-page":"69","DOI":"10.1201\/9781420018301.ch4","volume-title":"Practical Guide to Chemometrics","author":"Gempeline P.","year":"2006","edition":"2"},{"key":"ref22\/cit22","volume-title":"Electronic Statistics Textbook","author":"Hill T.","year":"2007"},{"key":"ref23\/cit23","first-page":"346","volume-title":"Encyclopedia of Computational Chemistry.","author":"Varmuza K.","year":"1998"},{"key":"ref24\/cit24","unstructured":"CODESSA PRO, version 1.0 RC2;University of Florida:Gainesville, FL, 2002."},{"key":"ref25\/cit25","doi-asserted-by":"crossref","first-page":"10400","DOI":"10.1021\/jp953224q","volume":"100","author":"Katritzky A. R.","year":"1996","journal-title":"J. Phys. Chem."},{"key":"ref26\/cit26","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1021\/ci9903206","volume":"40","author":"Katritzky A. R.","year":"2000","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"1551","DOI":"10.1135\/cccc19991551","volume":"64","author":"Karelson M.","year":"1999","journal-title":"Collect. Czech. Chem. Commun."},{"key":"ref28\/cit28","doi-asserted-by":"crossref","first-page":"358","DOI":"10.1021\/ci000124v","volume":"41","author":"Katritzky A. R.","year":"2001","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ref29\/cit29","doi-asserted-by":"crossref","first-page":"720","DOI":"10.1021\/ci980022t","volume":"38","author":"Katritzky A. R.","year":"1998","journal-title":"J. Chem. Inf. Comput. Sci."}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci1000828","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,3,21]],"date-time":"2023-03-21T23:00:40Z","timestamp":1679439640000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci1000828"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2010,7,1]]},"references-count":29,"journal-issue":{"issue":"7","published-print":{"date-parts":[[2010,7,26]]}},"alternative-id":["10.1021\/ci1000828"],"URL":"https:\/\/doi.org\/10.1021\/ci1000828","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2010,7,1]]}}}