| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 27th, 2009 | 46 | 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) | 5.98 | 16.06 | -98.09 | 3 | 8 | 2 | 75 | 626.794 | 10 | ↓ |
| Hi High (pH 8-9.5) | 5.98 | 12.53 | -18.69 | 1 | 8 | 0 | 73 | 624.778 | 10 | ↓ |
| Hi High (pH 8-9.5) | 5.98 | 13.46 | -69.42 | 0 | 8 | -1 | 76 | 623.77 | 10 | ↓ |
| Mid Mid (pH 6-8) | 5.98 | 14.3 | -54.55 | 2 | 8 | 1 | 74 | 625.786 | 10 | ↓ |
| Mid Mid (pH 6-8) | 5.98 | 14.29 | -50.86 | 2 | 8 | 1 | 74 | 625.786 | 10 | ↓ |
