PMC:7755033 / 16802-17437 JSONTXT

{"target":"https://pubannotation.org/docs/sourcedb/PMC/sourceid/7755033","sourcedb":"PMC","sourceid":"7755033","source_url":"https://www.ncbi.nlm.nih.gov/pmc/7755033","text":"2.2.1. Lipinski’s rule of five\nThe druglikeness of WS phytoconstituents was also assessed using Lipinski’s rule of five (Ertl et al., 2000; Lipinski et al., 1997; Veber et al., 2002). The parameters of druglikeness such as MW ≤500, logP ≤5, number of hydrogen bond donors (NOHNH) ≤5 and hydrogen bond acceptor sites (NON)≤10, topological polar surface area (TPSA) (≤140 Å2), and number of rotatable bonds (≤10) were determined. In the present study, the druglikeness of selected WS phytoconstituents was analyzed using Molinspiration (http://www.molinspiration.com/cgi-bin/properties) and compared to that of standard reference drugs.","divisions":[{"label":"label","span":{"begin":0,"end":6}},{"label":"title","span":{"begin":8,"end":31}}],"tracks":[{"project":"LitCovid-PubTator","denotations":[{"id":"336","span":{"begin":52,"end":54},"obj":"Species"},{"id":"337","span":{"begin":480,"end":482},"obj":"Species"},{"id":"338","span":{"begin":252,"end":260},"obj":"Chemical"},{"id":"339","span":{"begin":288,"end":296},"obj":"Chemical"}],"attributes":[{"id":"A336","pred":"tao:has_database_id","subj":"336","obj":"Tax:126910"},{"id":"A337","pred":"tao:has_database_id","subj":"337","obj":"Tax:126910"},{"id":"A338","pred":"tao:has_database_id","subj":"338","obj":"MESH:D006859"},{"id":"A339","pred":"tao:has_database_id","subj":"339","obj":"MESH:D006859"},{"subj":"336","pred":"source","obj":"LitCovid-PubTator"},{"subj":"337","pred":"source","obj":"LitCovid-PubTator"},{"subj":"338","pred":"source","obj":"LitCovid-PubTator"},{"subj":"339","pred":"source","obj":"LitCovid-PubTator"}],"namespaces":[{"prefix":"Tax","uri":"https://www.ncbi.nlm.nih.gov/taxonomy/"},{"prefix":"MESH","uri":"https://id.nlm.nih.gov/mesh/"},{"prefix":"Gene","uri":"https://www.ncbi.nlm.nih.gov/gene/"},{"prefix":"CVCL","uri":"https://web.expasy.org/cellosaurus/CVCL_"}]},{"project":"LitCovid-sentences","denotations":[{"id":"T140","span":{"begin":0,"end":6},"obj":"Sentence"},{"id":"T141","span":{"begin":8,"end":31},"obj":"Sentence"},{"id":"T142","span":{"begin":32,"end":184},"obj":"Sentence"},{"id":"T143","span":{"begin":185,"end":428},"obj":"Sentence"},{"id":"T144","span":{"begin":429,"end":635},"obj":"Sentence"}],"namespaces":[{"prefix":"_base","uri":"http://pubannotation.org/ontology/tao.owl#"}],"attributes":[{"subj":"T140","pred":"source","obj":"LitCovid-sentences"},{"subj":"T141","pred":"source","obj":"LitCovid-sentences"},{"subj":"T142","pred":"source","obj":"LitCovid-sentences"},{"subj":"T143","pred":"source","obj":"LitCovid-sentences"},{"subj":"T144","pred":"source","obj":"LitCovid-sentences"}]}],"config":{"attribute types":[{"pred":"source","value type":"selection","values":[{"id":"LitCovid-PubTator","color":"#ecb393","default":true},{"id":"LitCovid-sentences","color":"#9993ec"}]}]}}