| 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) | 5.03 | 8.76 | -60.34 | 1 | 7 | -1 | 99 | 517.396 | 10 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 9.68 | -119.46 | 0 | 7 | -2 | 102 | 516.388 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 5.03 | 8.01 | -17.24 | 2 | 7 | 0 | 96 | 518.404 | 10 | ↓ |
