| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 33 | 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) | 3.67 | 10.6 | -74.06 | 1 | 7 | 0 | 83 | 452.551 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.67 | 10.91 | -46.07 | 2 | 7 | 1 | 81 | 453.559 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 11.27 | -49.22 | 1 | 7 | 1 | 77 | 453.559 | 11 | ↓ |
