| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 15th, 2008 | 30 | 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) | 2.23 | 6.22 | -61.11 | 0 | 7 | -1 | 86 | 409.462 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 8.54 | -79.31 | 1 | 7 | 0 | 87 | 410.47 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.23 | 7.72 | -55.98 | 2 | 7 | 1 | 84 | 411.478 | 7 | ↓ |
