| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 31 | No |
| 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) | 4.39 | 13.17 | -197.55 | 5 | 4 | 3 | 47 | 430.701 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.39 | 9.36 | -45.18 | 3 | 4 | 1 | 41 | 428.685 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.39 | 10.7 | -121.01 | 4 | 4 | 2 | 46 | 429.693 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.39 | 11.83 | -91.35 | 4 | 4 | 2 | 42 | 429.693 | 10 | ↓ |
