| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2004 | 33 | 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) | 5.36 | 16.21 | -14.33 | 1 | 9 | 0 | 115 | 485.953 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.54 | 16 | -35.71 | 0 | 9 | -1 | 116 | 484.945 | 8 | ↓ |
| Mid Mid (pH 6-8) | 5.54 | 16.55 | -35.79 | 2 | 9 | 1 | 120 | 486.961 | 8 | ↓ |
