| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2008 | 30 | 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) | 2.54 | 12.46 | -49.24 | 1 | 8 | 1 | 66 | 411.53 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 7.81 | -36.13 | 1 | 8 | 1 | 66 | 411.53 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 7.55 | -14.77 | 0 | 8 | 0 | 65 | 410.522 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 10.3 | -93.88 | 2 | 8 | 2 | 67 | 412.538 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 10.28 | -103.74 | 2 | 8 | 2 | 67 | 412.538 | 4 | ↓ |
