| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 22 | 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) | 2.85 | 8.99 | -116.85 | 3 | 3 | 2 | 24 | 303.494 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.85 | 7.83 | -35.65 | 2 | 3 | 1 | 20 | 302.486 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | 6.77 | -39.22 | 2 | 3 | 1 | 23 | 302.486 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | 7.81 | -33.51 | 2 | 3 | 1 | 20 | 302.486 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.85 | 11.22 | -205.7 | 4 | 3 | 3 | 25 | 304.502 | 6 | ↓ |
