| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 30 | 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) | 3.18 | 6.32 | -14.77 | 3 | 7 | 0 | 104 | 427.457 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 4.37 | -40.88 | 2 | 7 | -1 | 107 | 426.449 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 5.63 | -39.57 | 3 | 7 | 0 | 112 | 427.457 | 5 | ↓ |
