| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 34 | 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) | 5.45 | 11.05 | -14.24 | 2 | 6 | 0 | 82 | 472.976 | 5 | ↓ |
| Ref Reference (pH 7) | 5.45 | 11 | -10.28 | 2 | 6 | 0 | 82 | 472.976 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.43 | 10.86 | -54.02 | 0 | 6 | -1 | 81 | 471.968 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.43 | 11.01 | -49.48 | 0 | 6 | -1 | 81 | 471.968 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.45 | 11.81 | -42.63 | 1 | 6 | -1 | 85 | 471.968 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.45 | 11.77 | -47.51 | 1 | 6 | -1 | 85 | 471.968 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.45 | 10.61 | -40.23 | 3 | 6 | 1 | 83 | 473.984 | 5 | ↓ |
