| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 18 | 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) | 3.02 | 8.14 | -43.15 | 2 | 2 | 1 | 29 | 241.358 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 7.21 | -4.31 | 1 | 2 | 0 | 25 | 240.35 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.02 | 8.59 | -102.54 | 3 | 2 | 2 | 31 | 242.366 | 5 | ↓ |
