| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 35 | 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) | 5.91 | 18.76 | -103.03 | 2 | 5 | 2 | 30 | 473.709 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.91 | 14.76 | -5.6 | 0 | 5 | 0 | 28 | 471.693 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.91 | 17.14 | -46.54 | 1 | 5 | 1 | 29 | 472.701 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.91 | 16.36 | -36.17 | 1 | 5 | 1 | 29 | 472.701 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 5.91 | 18.91 | -184.61 | 3 | 5 | 3 | 31 | 474.717 | 9 | ↓ |
