| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2010 | 15 | 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) | 1.89 | 5.64 | -41.46 | 3 | 3 | 1 | 44 | 208.329 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.89 | 5.01 | -4.07 | 2 | 3 | 0 | 42 | 207.321 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.89 | 5.36 | -23.81 | 3 | 3 | 1 | 43 | 208.329 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.89 | 5.75 | -103.93 | 4 | 3 | 2 | 45 | 209.337 | 5 | ↓ |
