| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2008 | 15 | 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) | 0.79 | 2.81 | -34.63 | 3 | 4 | 1 | 47 | 227.357 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | 2.82 | -33.78 | 3 | 4 | 1 | 47 | 227.357 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | 0.43 | -6.74 | 2 | 4 | 0 | 45 | 226.349 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.79 | 3.18 | -83.42 | 4 | 4 | 2 | 48 | 228.365 | 3 | ↓ |
