| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | 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) | 3.82 | 9.59 | -108.75 | 3 | 3 | 2 | 30 | 294.483 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 8.17 | -32.08 | 2 | 3 | 1 | 29 | 293.475 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 7.32 | -1.87 | 1 | 3 | 0 | 24 | 292.467 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 8.81 | -28.38 | 2 | 3 | 1 | 26 | 293.475 | 10 | ↓ |
