| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 10 | 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) | 1.81 | 2.2 | -4.82 | 3 | 3 | 0 | 55 | 159.62 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 2.2 | -4.48 | 3 | 3 | 0 | 55 | 159.62 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 2.32 | -27.4 | 4 | 3 | 1 | 56 | 160.628 | 1 | ↓ |
