| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 33 | 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) | 3.21 | 14.83 | -191.8 | 4 | 7 | 3 | 59 | 450.655 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 10.2 | -21.51 | 2 | 7 | 1 | 53 | 448.639 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 12.53 | -102.2 | 3 | 7 | 2 | 58 | 449.647 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 12.74 | -116.05 | 3 | 7 | 2 | 58 | 449.647 | 7 | ↓ |
