| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 17 | 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) | 1.76 | 5.45 | -8.94 | 1 | 3 | 0 | 42 | 226.279 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | 4.5 | -32.1 | 2 | 3 | 1 | 47 | 227.287 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | 3.98 | -31.24 | 2 | 3 | 1 | 47 | 227.287 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 5.72 | -37.48 | 2 | 3 | 1 | 43 | 227.287 | 3 | ↓ |
