| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2006 | 27 | 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) | 3.14 | 4.56 | -12.4 | 3 | 6 | 0 | 89 | 383.835 | 4 | ↓ |
| Ref Reference (pH 7) | 3.14 | 4.52 | -9.61 | 3 | 6 | 0 | 89 | 383.835 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 4.92 | -43.8 | 1 | 6 | -1 | 88 | 382.827 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 4.49 | -53.11 | 1 | 6 | -1 | 88 | 382.827 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 5.27 | -39.05 | 2 | 6 | -1 | 92 | 382.827 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 5.29 | -47.6 | 2 | 6 | -1 | 92 | 382.827 | 4 | ↓ |
