| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 26th, 2008 | 16 | Yes |
| 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) | -0.13 | 0.7 | -47.27 | 2 | 5 | -1 | 82 | 215.236 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.33 | -1.28 | -112.91 | 1 | 5 | -2 | 85 | 214.228 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.33 | 0.2 | -76.23 | 3 | 5 | 0 | 89 | 216.244 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.13 | 1.44 | -55.76 | 4 | 5 | 1 | 86 | 217.252 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.13 | 0.87 | -67.9 | 4 | 5 | 1 | 86 | 217.252 | 3 | ↓ |
