| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 15th, 2007 | 32 | 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) | 4.60 | 9.7 | -13.99 | 2 | 6 | 0 | 78 | 425.488 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.58 | 9.94 | -57.74 | 0 | 6 | -1 | 77 | 424.48 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.58 | 10.15 | -45.93 | 0 | 6 | -1 | 77 | 424.48 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.60 | 10.6 | -45.43 | 1 | 6 | -1 | 81 | 424.48 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.60 | 10.46 | -53.6 | 1 | 6 | -1 | 81 | 424.48 | 6 | ↓ |
