| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 22nd, 2009 | 27 | 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) | 2.99 | 7.23 | -43.96 | 2 | 5 | 1 | 58 | 369.416 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.99 | 5.42 | -40.62 | 0 | 5 | -1 | 60 | 367.4 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 7.13 | -42.71 | 2 | 5 | 1 | 58 | 369.416 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 4.85 | -8.63 | 1 | 5 | 0 | 57 | 368.408 | 3 | ↓ |
