| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 13 | 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) | 0.98 | 2.14 | -36.77 | 2 | 3 | 1 | 29 | 187.307 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 0.93 | -2.43 | 1 | 3 | 0 | 24 | 186.299 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.98 | 4.57 | -102.44 | 3 | 3 | 2 | 30 | 188.315 | 6 | ↓ |
