| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 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) | 2.99 | 8.74 | -52.1 | 0 | 8 | -1 | 115 | 409.418 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | 10.41 | -14.82 | 0 | 8 | 0 | 110 | 410.426 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 9.97 | -16.69 | 1 | 8 | 0 | 113 | 410.426 | 8 | ↓ |
