| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 29 | 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) | 0.56 | 10.69 | -113.55 | 3 | 6 | 0 | 93 | 403.429 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.56 | 8.68 | -66.2 | 4 | 6 | 1 | 90 | 404.437 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -2.18 | 7.63 | -85.51 | 4 | 6 | 1 | 96 | 404.437 | 2 | ↓ |
