| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 31 | 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) | 1.61 | 5.88 | -95.66 | 3 | 8 | 2 | 79 | 435.613 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 1.23 | -7.91 | 1 | 8 | 0 | 76 | 433.597 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.61 | 3.72 | -45.08 | 2 | 8 | 1 | 77 | 434.605 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.61 | 3.39 | -39.13 | 2 | 8 | 1 | 77 | 434.605 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.61 | 5.92 | -86.79 | 3 | 8 | 2 | 79 | 435.613 | 7 | ↓ |
