| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 38 | No |
None
None
| 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) | 3.48 | 11.75 | -63.23 | 2 | 8 | 1 | 95 | 515.586 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.48 | 10.19 | -46.76 | 0 | 8 | -1 | 97 | 513.57 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 12.33 | -36.89 | 1 | 8 | 0 | 98 | 514.578 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 9.6 | -23.21 | 1 | 8 | 0 | 94 | 514.578 | 5 | ↓ |
