| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 16th, 2008 | 29 | No |
| 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) | 6.16 | 9.41 | -9.51 | 2 | 5 | 0 | 75 | 408.523 | 6 | ↓ |
| Ref Reference (pH 7) | 6.16 | 9.7 | -9.45 | 2 | 5 | 0 | 75 | 408.523 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.62 | 7.39 | -48.55 | 1 | 5 | -1 | 78 | 407.515 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.62 | 7.88 | -48.08 | 1 | 5 | -1 | 78 | 407.515 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.67 | 9.71 | -46.6 | 1 | 5 | -1 | 74 | 407.515 | 7 | ↓ |
