| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 36 | 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) | 5.34 | 9.71 | -14.04 | 3 | 7 | 0 | 99 | 503.986 | 6 | ↓ |
| Ref Reference (pH 7) | 5.34 | 9.33 | -12.98 | 3 | 7 | 0 | 99 | 503.986 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.31 | 9.91 | -43.7 | 1 | 7 | -1 | 98 | 502.978 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.31 | 9.59 | -54.06 | 1 | 7 | -1 | 98 | 502.978 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.34 | 10.48 | -39.84 | 2 | 7 | -1 | 102 | 502.978 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.34 | 10.1 | -48.61 | 2 | 7 | -1 | 102 | 502.978 | 6 | ↓ |
