Table 3.
Compound | Molecular descriptors | |||||||
---|---|---|---|---|---|---|---|---|
GATS7e | μi | H-047 | Mp | G3m | logP | G2p | G3p | |
C-1310 | 1.07 | 3.70 | 13 | 0.66 | 0.16 | −1.98 | 0.15 | 0.15 |
C-1311 | 0.92 | 3.06 | 16 | 0.66 | 0.15 | −2.19 | 0.15 | 0.15 |
C-1330 | 1.19 | 3.16 | 16 | 0.66 | 0.15 | −2.15 | 0.15 | 0.15 |
C-1415 | 0.90 | 2.32 | 14 | 0.67 | 0.15 | −1.16 | 0.15 | 0.15 |
C-1419 | 0.89 | 2.01 | 13 | 0.66 | 0.15 | −2.19 | 0.15 | 0.16 |
C-1558 | 2.13 | 2.28 | 13 | 0.65 | 0.15 | 0.15 | 0.15 | 0.15 |
C-1176 | 0.94 | 2.50 | 16 | 0.68 | 0.16 | −1.12 | 0.16 | 0.16 |
C-1263 | 0.90 | 3.34 | 15 | 0.67 | 0.16 | −2.87 | 0.16 | 0.16 |
C-1212 | 1.01 | 2.61 | 16 | 0.67 | 0.16 | −1.79 | 0.16 | 0.16 |
C-1371 | 0.94 | 2.11 | 15 | 0.67 | 0.15 | −2.82 | 0.15 | 0.15 |
C-1554 | 0.83 | 2.66 | 13 | 0.66 | 0.15 | −1.01 | 0.15 | 0.15 |
C-1266 | 0.86 | 2.60 | 13 | 0.66 | 0.15 | −0.95 | 0.15 | 0.16 |
C-1492 | 0.86 | 3.10 | 15 | 0.66 | 0.15 | −1.97 | 0.15 | 0.15 |
C-1233 | 0.99 | 2.99 | 16 | 0.68 | 0.17 | −1.12 | 0.17 | 0.16 |
C-1303 | 0.87 | 2.48 | 15 | 0.67 | 0.16 | −2.14 | 0.16 | 0.16 |
C-1533 | 0.91 | 1.11 | 15 | 0.67 | 0.16 | −1.78 | 0.17 | 0.16 |
C-1567 | 2.15 | 3.53 | 15 | 0.66 | 0.15 | 0.2 | 0.15 | 0.15 |
C-1410 | 0.86 | 2.39 | 11 | 0.67 | 0.16 | −2.16 | 0.16 | 0.16 |
C-1296 | 0.94 | 3.08 | 19 | 0.67 | 0.16 | −1.06 | 0.17 | 0.16 |
C-1305 | 0.81 | 2.44 | 18 | 0.67 | 0.17 | −2.09 | 0.16 | 0.16 |