| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | 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) | 1.05 | 3.65 | -10.5 | 1 | 5 | 0 | 63 | 248.282 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 2.67 | -30.4 | 1 | 5 | 0 | 67 | 248.282 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 4.66 | -52.42 | 0 | 5 | -1 | 65 | 247.274 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.05 | 1.92 | -40.58 | 2 | 5 | 1 | 64 | 249.29 | 1 | ↓ |
