| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 16 | 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) | -0.05 | -0.1 | -102.47 | 6 | 4 | 2 | 57 | 230.4 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | -2.59 | -36.96 | 5 | 4 | 1 | 53 | 229.392 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 0.12 | -95.15 | 6 | 4 | 2 | 57 | 230.4 | 1 | ↓ |
