| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 37 | 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) | 3.57 | 8.25 | -19.04 | 2 | 9 | 0 | 110 | 520.973 | 7 | ↓ |
| Ref Reference (pH 7) | 3.57 | 7.71 | -14.31 | 2 | 9 | 0 | 110 | 520.973 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.55 | 7.78 | -59.19 | 0 | 9 | -1 | 109 | 519.965 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.55 | 7.53 | -47.65 | 0 | 9 | -1 | 109 | 519.965 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.57 | 9.02 | -42.94 | 1 | 9 | -1 | 113 | 519.965 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 8.47 | -49.64 | 1 | 9 | -1 | 113 | 519.965 | 7 | ↓ |
