| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2010 | 32 | Yes |
None
| 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) | 4.02 | 4.82 | -52.03 | 3 | 8 | -1 | 136 | 441.456 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.02 | 6.63 | -133.49 | 2 | 8 | -2 | 139 | 440.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.02 | 4.81 | -50.97 | 3 | 8 | -1 | 136 | 441.456 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.02 | 6.61 | -106.38 | 2 | 8 | -2 | 139 | 440.448 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.02 | 4.04 | -12.5 | 4 | 8 | 0 | 134 | 442.464 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.02 | 6.8 | -102.04 | 2 | 8 | -2 | 139 | 440.448 | 5 | ↓ |
