| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2008 | 28 | 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) | 2.21 | 7.92 | -45.55 | 3 | 7 | 1 | 79 | 402.544 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 5.57 | -11.35 | 2 | 7 | 0 | 78 | 401.536 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.21 | 8.3 | -100.42 | 4 | 7 | 2 | 80 | 403.552 | 6 | ↓ |
