| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 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) | 1.82 | 3.78 | -52.91 | 2 | 6 | 0 | 79 | 301.346 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 5.67 | -69.43 | 2 | 6 | 0 | 79 | 301.346 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 3.32 | -52.08 | 1 | 6 | -1 | 78 | 300.338 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 6.12 | -100 | 3 | 6 | 1 | 80 | 302.354 | 5 | ↓ |
