| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 33 | Yes |
| 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) | 4.83 | 6.85 | -9.79 | 3 | 7 | 0 | 99 | 469.969 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.81 | 7.25 | -45.09 | 1 | 7 | -1 | 98 | 468.961 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.81 | 6.82 | -53.55 | 1 | 7 | -1 | 98 | 468.961 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.83 | 7.6 | -40.53 | 2 | 7 | -1 | 102 | 468.961 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.83 | 7.62 | -47.6 | 2 | 7 | -1 | 102 | 468.961 | 8 | ↓ |
