| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 22 | 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) | 0.91 | 6.72 | -10.6 | 2 | 7 | 0 | 89 | 300.318 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 6.94 | -46.12 | 3 | 7 | 1 | 94 | 301.326 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 5.2 | -45.83 | 2 | 7 | -1 | 95 | 299.31 | 2 | ↓ |
