| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 32 | 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) | 1.77 | 6.29 | -61.91 | 0 | 7 | -1 | 86 | 458.535 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.22 | 8.93 | -51.58 | 2 | 7 | 1 | 84 | 460.551 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.19 | -1.39 | -54.09 | 1 | 7 | 1 | 81 | 460.551 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 8.62 | -72.36 | 1 | 7 | 0 | 87 | 459.543 | 7 | ↓ |
