| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 16th, 2008 | 28 | 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) | 3.28 | 9.08 | -66.12 | 0 | 6 | -1 | 86 | 393.444 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.70 | 9.3 | -11.54 | 0 | 6 | 0 | 80 | 394.452 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 9.41 | -12.74 | 1 | 6 | 0 | 84 | 394.452 | 3 | ↓ |
