| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 36 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -1.20 | 9.65 | -73.99 | 2 | 13 | -1 | 199 | 496.408 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.20 | 8.62 | -127.2 | 1 | 13 | -2 | 194 | 495.4 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.20 | 8.7 | -138.62 | 1 | 13 | -2 | 194 | 495.4 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.20 | 7.64 | -34.86 | 3 | 13 | 0 | 196 | 497.416 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -1.20 | 7.71 | -40.3 | 3 | 13 | 0 | 196 | 497.416 | 6 | ↓ |
