| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 35 | 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) | 4.11 | 8.9 | -60.99 | 0 | 7 | -1 | 82 | 497.999 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.56 | 10.87 | -46.11 | 2 | 7 | 1 | 81 | 500.015 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 11.51 | -45.67 | 1 | 7 | 1 | 77 | 500.015 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.11 | 11.23 | -72.1 | 1 | 7 | 0 | 83 | 499.007 | 10 | ↓ |
