| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 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) | 0.54 | 4.22 | -19.61 | 2 | 9 | 0 | 111 | 420.52 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.54 | 5.35 | -42.62 | 3 | 9 | 1 | 112 | 421.528 | 7 | ↓ |
