| 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 | 6.26 | -55.97 | 0 | 7 | -1 | 86 | 458.535 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.19 | -1.6 | -52.87 | 1 | 7 | 1 | 81 | 460.551 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.22 | 8.94 | -47.72 | 2 | 7 | 1 | 84 | 460.551 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 8.58 | -72.18 | 1 | 7 | 0 | 87 | 459.543 | 7 | ↓ |
