| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 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) | 4.50 | 13.82 | -54.57 | 2 | 7 | 1 | 66 | 463.993 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.50 | 11.46 | -11.62 | 1 | 7 | 0 | 65 | 462.985 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | 14.13 | -100.35 | 3 | 7 | 2 | 67 | 465.001 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | 11.78 | -37.21 | 2 | 7 | 1 | 66 | 463.993 | 3 | ↓ |
