| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2010 | 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) | -5.82 | -19.32 | -286.06 | 20 | 15 | 4 | 295 | 487.551 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.82 | -19.75 | -198.58 | 19 | 15 | 3 | 293 | 486.543 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.82 | -19.49 | -102.57 | 18 | 15 | 2 | 292 | 485.535 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.82 | -20.06 | -106.97 | 18 | 15 | 2 | 292 | 485.535 | 6 | ↓ |
| Mid Mid (pH 6-8) | -5.82 | -18.91 | -403.67 | 21 | 15 | 5 | 297 | 488.559 | 6 | ↓ |
