| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2007 | 32 | 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) | 3.09 | 6.83 | -56.56 | 0 | 7 | -1 | 82 | 455.556 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.51 | 8.93 | -46.85 | 1 | 7 | 1 | 77 | 457.572 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 8.43 | -45.47 | 2 | 7 | 1 | 81 | 457.572 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 9.18 | -71.51 | 1 | 7 | 0 | 83 | 456.564 | 9 | ↓ |
