| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 29 | 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) | 4.20 | 5.9 | -12.38 | 3 | 6 | 0 | 89 | 432.307 | 4 | ↓ |
| Ref Reference (pH 7) | 4.20 | 5.86 | -10.37 | 3 | 6 | 0 | 89 | 432.307 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.20 | 6.67 | -43.41 | 2 | 6 | -1 | 92 | 431.299 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 5.64 | -55.42 | 1 | 6 | -1 | 88 | 431.299 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 6.45 | -53.17 | 1 | 6 | -1 | 88 | 431.299 | 4 | ↓ |
