| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 29 | No |
| 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) | -0.96 | 4.15 | -53.09 | 3 | 8 | -1 | 128 | 395.391 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.78 | 1.19 | -72.39 | 3 | 8 | -1 | 139 | 395.391 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.96 | 5.15 | -52.11 | 4 | 8 | 0 | 132 | 396.399 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.96 | 3.75 | -41.27 | 4 | 8 | 0 | 132 | 396.399 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.78 | 2.74 | -90.91 | 3 | 8 | -1 | 139 | 395.391 | 5 | ↓ |
