| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 28th, 2008 | 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) | 3.97 | 8.43 | -14.17 | 2 | 7 | 0 | 91 | 460.921 | 5 | ↓ |
| Ref Reference (pH 7) | 3.97 | 8.36 | -11.05 | 2 | 7 | 0 | 91 | 460.921 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 8.23 | -53.57 | 0 | 7 | -1 | 90 | 459.913 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 8.38 | -49.97 | 0 | 7 | -1 | 90 | 459.913 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 9.18 | -46.09 | 1 | 7 | -1 | 94 | 459.913 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.97 | 9.14 | -48.46 | 1 | 7 | -1 | 94 | 459.913 | 5 | ↓ |
