From: Titanocene / cyclodextrin supramolecular systems: a theoretical approach
No(a) | Code | A 1 | A 2 | A 3 | pA 1 (b) | pA 2 (b) | pA 3 (b) | pA 1 ( pred .) (b) | pA 2 ( pred .) (b) | pA 3 ( pred .) (b) | pA 2 , Rf ( pred .) (b) | ΔpA 1 (b) | ΔpA 2 (b) | ΔpA 3 (b) | ΔpA 2 , Rf (b) |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
( IC 50 , HeLa , μM) (b) | ( IC 50 , K562 , μM) (b) | ( IC 50 , Fem - x , μM) (b) | |||||||||||||
1 | 01TC | 79.2±6.9 | 63.7±9.5 | 134.3±18.1 | 4.10 | 4.20 | 3.87 | 3.99 | 4.13 | 3.97 | 4.18 | 0.11 | 0.07 | −0.10 | 0.02 |
2 | 02TC | 108.6±8.6 | 59.4±8 | 116.3±8.7 | 3.96 | 4.23 | 3.93 | 3.95 | 4.09 | 3.94 | 4.04 | 0.01 | 0.14 | −0.01 | 0.19 |
3 | 03TC | 189±13.1 | 155.2±8.7 | 200 | 3.72 | 3.81 | 3.70 | 3.65 | 3.79 | 3.77 | 3.89 | 0.07 | 0.02 | −0.07 | −0.08 |
4 | 08TC | 135±6 | 66±6 | 96±4 | 3.87 | 4.18 | 4.02 | 3.90 | 4.04 | 3.92 | 4.23 | −0.03 | 0.14 | 0.11 | −0.05 |
5 | 09TC | 154±4 | 73±1 | 106±5 | 3.81 | 4.14 | 3.97 | 4.13 | 4.27 | 4.04 | 4.21 | −0.32 | −0.13 | −0.07 | −0.07 |
6 | 10TC | 109±9 | 59±8 | 116±9 | 3.96 | 4.23 | 3.94 | 3.95 | 4.09 | 3.94 | 4.04 | 0.01 | 0.14 | −0.00 | 0.19 |
7 | 11TC | 117±3 | 88±4 | 101±9 | 3.93 | 4.06 | 4.00 | 3.96 | 4.10 | 3.95 | 4.17 | −0.03 | −0.04 | 0.05 | −0.11 |
8 | 18TC | 200 | 200 | 3.70 | 3.70 | 3.83 | 3.97 | 3.79 | −0.13 | −0.27 | −0.09 | ||||
9 | 23TC | 114.2±57 | 3.94 | 3.75 | 0.19 | ||||||||||
10 | 24TC | 55.9±16.2 | 4.25 | 4.53 | −0.28 | ||||||||||
11 | 26TC | 10.8±0.6 | 4.97 | 4.53 | 0.45 |