| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2008 | 29 | Yes |
None
| 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) | 2.68 | 11.33 | -14.84 | 0 | 4 | 0 | 68 | 404.453 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.85 | 11.16 | -116.63 | 0 | 4 | -2 | 80 | 402.437 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.85 | 10.23 | -52.13 | 1 | 4 | -1 | 77 | 403.445 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.26 | 12.34 | -39.14 | 0 | 4 | -1 | 74 | 403.445 | 3 | ↓ |
