| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2010 | 14 | 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) | 1.65 | 4.92 | -41.18 | 3 | 3 | 1 | 44 | 194.302 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.65 | 4.52 | -4.12 | 2 | 3 | 0 | 42 | 193.294 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 4.85 | -23.02 | 3 | 3 | 1 | 43 | 194.302 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.65 | 5.25 | -103.23 | 4 | 3 | 2 | 45 | 195.31 | 5 | ↓ |
