| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 30 | 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) | 3.66 | 7.8 | -14.77 | 2 | 6 | 0 | 82 | 461.319 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 8.59 | -53.58 | 1 | 6 | -1 | 85 | 460.311 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.66 | 8.27 | -41.42 | 3 | 6 | 1 | 83 | 462.327 | 4 | ↓ |
