| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 28th, 2007 | 32 | 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) | 3.72 | 8.46 | -34.47 | 4 | 11 | 1 | 142 | 458.934 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.72 | 6.1 | -12.62 | 3 | 11 | 0 | 140 | 457.926 | 7 | ↓ |
