| Id |
Subject |
Object |
Predicate |
Lexical cue |
| T175 |
0-72 |
Sentence |
denotes |
Fig. 7 Chemical properties statistics of hub components in the formulae. |
| T176 |
73-75 |
Sentence |
denotes |
A: |
| T177 |
76-376 |
Sentence |
denotes |
Molecular weight, B: rotatable bond count, C: H-bond acceptors count, D: H-bond donors count, E: topological polar surface area (TPSA), F: leadlikeness violations, G: pharmacokinetic and toxicity evaluated parameters of 20 leadlikeness compounds by pkCSM; green = good, yellow = tolerable, red = bad. |
| T178 |
377-383 |
Sentence |
denotes |
Caco2: |
| T179 |
384-408 |
Sentence |
denotes |
Caco-2 Permeability,HIA: |
| T180 |
409-445 |
Sentence |
denotes |
Intestinal Absorption (Human), Skin: |
| T181 |
446-498 |
Sentence |
denotes |
Skin Permeability, VDss: volume of distribution, FU: |
| T182 |
499-529 |
Sentence |
denotes |
Fraction Unbound (Human), BBB: |
| T183 |
530-568 |
Sentence |
denotes |
Blood Brain Barrier permeability, CNS: |
| T184 |
569-608 |
Sentence |
denotes |
Central Nervous System permeability,TC: |
| T185 |
609-631 |
Sentence |
denotes |
Total Clearance, OCT2: |
| T186 |
632-694 |
Sentence |
denotes |
Renal Organic Cation Transporter 2, AMES: AMES toxicity, MTDD: |
| T187 |
695-769 |
Sentence |
denotes |
Maximum Tolerated Dose (Human), hERG I/II: hERG I and II Inhibitors, LD50: |
| T188 |
770-805 |
Sentence |
denotes |
Oral Rat Acute Toxicity (LD50), HT: |
| T189 |
806-825 |
Sentence |
denotes |
Hepatotoxicity, SS: |
| T190 |
826-849 |
Sentence |
denotes |
Skin Sensitisation, MT: |
| T191 |
850-997 |
Sentence |
denotes |
Minnow toxicity. (For interpretation of the references to colour in this figure legend, the reader is referred to the web version of this article.) |
