| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 34 | 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) | 4.39 | 11.05 | -43.75 | 2 | 5 | 1 | 50 | 502.079 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.39 | 8.76 | -11.41 | 1 | 5 | 0 | 48 | 501.071 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.39 | 13.27 | -106.42 | 3 | 5 | 2 | 51 | 503.087 | 10 | ↓ |
