| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2011 | 17 | 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) | 3.27 | 7.05 | -28.36 | 2 | 3 | 1 | 43 | 224.287 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.27 | 6.67 | -8.48 | 1 | 3 | 0 | 42 | 223.279 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.27 | 7.54 | -96.03 | 3 | 3 | 2 | 44 | 225.295 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.27 | 7.12 | -35.22 | 2 | 3 | 1 | 43 | 224.287 | 1 | ↓ |
