| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 33 | 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) | 1.06 | 0.08 | -50.8 | 3 | 9 | 1 | 96 | 462.546 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 2.42 | -103.26 | 4 | 9 | 2 | 97 | 463.554 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | -2.19 | -12.43 | 2 | 9 | 0 | 94 | 461.538 | 8 | ↓ |
