| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2006 | 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) | 4.01 | 10.45 | -58.92 | 0 | 6 | -1 | 83 | 416.453 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.45 | 1.92 | -21.82 | 1 | 6 | 0 | 79 | 417.461 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.42 | 1.39 | -12.13 | 0 | 6 | 0 | 76 | 417.461 | 7 | ↓ |
