| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 20 | 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) | 3.38 | 8.31 | -116.99 | 3 | 3 | 2 | 30 | 282.472 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 4.93 | -0.97 | 1 | 3 | 0 | 24 | 280.456 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 6.44 | -35.15 | 2 | 3 | 1 | 29 | 281.464 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 7.27 | -30.09 | 2 | 3 | 1 | 26 | 281.464 | 4 | ↓ |
