| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 22nd, 2007 | 37 | 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) | 3.91 | 9.85 | -60.58 | 0 | 7 | -1 | 82 | 497.571 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.35 | 12.47 | -46.9 | 2 | 7 | 1 | 81 | 499.587 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | -0.79 | -48.66 | 1 | 7 | 1 | 77 | 499.587 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.91 | 12.19 | -70.53 | 1 | 7 | 0 | 83 | 498.579 | 9 | ↓ |
