| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | 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) | 3.17 | 8.18 | -31.72 | 2 | 3 | 1 | 29 | 291.459 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 6.57 | -2.27 | 1 | 3 | 0 | 24 | 290.451 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 8.6 | -29.12 | 2 | 3 | 1 | 26 | 291.459 | 6 | ↓ |
