| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 34 | 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) | 5.03 | 13.67 | -72.87 | 1 | 6 | 0 | 74 | 464.606 | 12 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 11.37 | -57.58 | 0 | 6 | -1 | 73 | 463.598 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.45 | 1.61 | -43.55 | 1 | 6 | 1 | 68 | 465.614 | 12 | ↓ |
