| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 29 | 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) | 3.43 | 7.47 | -14.3 | 2 | 6 | 0 | 78 | 409.511 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 7.71 | -58.82 | 0 | 6 | -1 | 77 | 408.503 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 7.93 | -46.02 | 0 | 6 | -1 | 77 | 408.503 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 8.38 | -45.43 | 1 | 6 | -1 | 81 | 408.503 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 8.23 | -53.97 | 1 | 6 | -1 | 81 | 408.503 | 7 | ↓ |
