| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2007 | 38 | 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) | 5.17 | 11.2 | -59.38 | 0 | 7 | -1 | 82 | 519.662 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.58 | 13.32 | -48.88 | 1 | 7 | 1 | 77 | 521.678 | 11 | ↓ |
| Mid Mid (pH 6-8) | 5.61 | 13.35 | -46.4 | 2 | 7 | 1 | 81 | 521.678 | 10 | ↓ |
| Mid Mid (pH 6-8) | 5.17 | 13.52 | -77.94 | 1 | 7 | 0 | 83 | 520.67 | 11 | ↓ |
