| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 14th, 2007 | 35 | Yes |
| 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) | 1.98 | 1.86 | -38.47 | 1 | 10 | -1 | 130 | 516.474 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 3.01 | -39.79 | 1 | 10 | -1 | 125 | 516.474 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 3.45 | -14.65 | 2 | 10 | 0 | 123 | 517.482 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.98 | 1.03 | -18.11 | 2 | 10 | 0 | 127 | 517.482 | 10 | ↓ |
