| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 28 | No |
| 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) | 3.84 | 8.11 | -43.8 | 1 | 6 | -1 | 87 | 507.329 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.84 | 8.86 | -96.93 | 0 | 6 | -2 | 90 | 506.321 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.38 | 9.17 | -12.33 | 2 | 6 | 0 | 84 | 508.337 | 4 | ↓ |
