| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2008 | 12 | 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) | 3.35 | 0.9 | -5.24 | 2 | 3 | 0 | 53 | 206.028 | 1 | ↓ |
| Ref Reference (pH 7) | 3.35 | 0.55 | -5.73 | 2 | 3 | 0 | 53 | 206.028 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | 1.33 | -32.43 | 1 | 3 | -1 | 56 | 205.02 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 1.65 | -38.22 | 1 | 3 | -1 | 56 | 205.02 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 3.34 | -33.15 | 1 | 3 | -1 | 52 | 205.02 | 1 | ↓ |
