| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 35 | 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) | 2.13 | 5.04 | -59.24 | 0 | 9 | -1 | 101 | 481.525 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 7.77 | -46.18 | 2 | 9 | 1 | 99 | 483.541 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 7.55 | -46.71 | 1 | 9 | 1 | 96 | 483.541 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 7.38 | -73.07 | 1 | 9 | 0 | 102 | 482.533 | 9 | ↓ |
