| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 24th, 2006 | 18 | 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) | 2.06 | 0.7 | -10.03 | 4 | 6 | 0 | 100 | 246.27 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | -0.93 | -45.02 | 3 | 6 | -1 | 103 | 245.262 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | -1.18 | -43.22 | 3 | 6 | -1 | 103 | 245.262 | 2 | ↓ |
