| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2010 | 16 | 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) | 0.04 | 3.33 | -43.55 | 3 | 4 | 1 | 53 | 222.312 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.04 | 2.92 | -5.86 | 2 | 4 | 0 | 51 | 221.304 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.04 | 3.2 | -26.85 | 3 | 4 | 1 | 53 | 222.312 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.04 | 3.6 | -107.79 | 4 | 4 | 2 | 54 | 223.32 | 3 | ↓ |
