| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2008 | 27 | No |
None
| 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) | 2.94 | 7.7 | -29.5 | 1 | 5 | 0 | 61 | 368.408 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.94 | 5.29 | -41.05 | 0 | 5 | -1 | 60 | 367.4 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.94 | 7.91 | -48.53 | 1 | 5 | 0 | 61 | 368.408 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 6.97 | -45.63 | 2 | 5 | 1 | 58 | 369.416 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 4.98 | -8.9 | 1 | 5 | 0 | 57 | 368.408 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.94 | 6.9 | -46.22 | 2 | 5 | 1 | 58 | 369.416 | 3 | ↓ |
