| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 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) | 2.71 | 7.31 | -59.68 | 0 | 8 | -1 | 97 | 452.483 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.16 | 6.5 | -32.7 | 1 | 8 | 0 | 95 | 453.491 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 7.49 | -26.13 | 0 | 8 | 0 | 91 | 453.491 | 11 | ↓ |
