| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 32 | 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) | 5.13 | 9.33 | -50.24 | 1 | 11 | -1 | 170 | 457.444 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.68 | 10.44 | -23.69 | 2 | 11 | 0 | 167 | 458.452 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.68 | 11.46 | -54.5 | 1 | 11 | -1 | 170 | 457.444 | 8 | ↓ |
