| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2008 | 26 | 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) | 3.10 | 7.46 | -26.53 | 1 | 5 | 0 | 61 | 370.474 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 5.12 | -43.64 | 0 | 5 | -1 | 60 | 369.466 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 6.96 | -45.59 | 2 | 5 | 1 | 58 | 371.482 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 7.59 | -54.71 | 1 | 5 | 0 | 61 | 370.474 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 4.49 | -10.81 | 1 | 5 | 0 | 57 | 370.474 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.10 | 6.84 | -48.85 | 2 | 5 | 1 | 58 | 371.482 | 3 | ↓ |
