| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2010 | 33 | 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) | 2.62 | 3.69 | -54.69 | 2 | 9 | -1 | 133 | 517.308 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.62 | 4.6 | -110.93 | 1 | 9 | -2 | 135 | 516.3 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.62 | 2.8 | -12.09 | 3 | 9 | 0 | 130 | 518.316 | 7 | ↓ |
