| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 30 | 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) | 2.45 | 5.65 | -13.68 | 2 | 7 | 0 | 78 | 410.518 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.45 | 7.89 | -47.3 | 3 | 7 | 1 | 79 | 411.526 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.45 | 5.99 | -37.45 | 3 | 7 | 1 | 79 | 411.526 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.45 | 8.21 | -102.89 | 4 | 7 | 2 | 80 | 412.534 | 9 | ↓ |
