| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2010 | 31 | 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) | 4.18 | 7.04 | -58.15 | 1 | 7 | -1 | 99 | 489.342 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.18 | 7.96 | -115.79 | 0 | 7 | -2 | 102 | 488.334 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.18 | 6.29 | -15.33 | 2 | 7 | 0 | 96 | 490.35 | 8 | ↓ |
