| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2008 | 34 | 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) | 3.78 | 10.93 | -72.71 | 1 | 7 | 0 | 87 | 477.586 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.78 | 8.39 | -57.82 | 0 | 7 | -1 | 86 | 476.578 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 9.81 | -59.26 | 2 | 7 | 1 | 84 | 478.594 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.19 | 10.83 | -60.22 | 1 | 7 | 1 | 81 | 478.594 | 8 | ↓ |
