| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 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) | 4.50 | 7.31 | -46.08 | 1 | 5 | -1 | 78 | 416.404 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.04 | 9.24 | -12.17 | 2 | 5 | 0 | 75 | 417.412 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.04 | 8.69 | -18.18 | 2 | 5 | 0 | 75 | 417.412 | 4 | ↓ |
