| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 20th, 2008 | 11 | 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) | 2.95 | 0.01 | -6.9 | 2 | 3 | 0 | 53 | 171.583 | 1 | ↓ |
| Ref Reference (pH 7) | 2.95 | 0.35 | -5.53 | 2 | 3 | 0 | 53 | 171.583 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.32 | 3.09 | -36.54 | 1 | 3 | -1 | 52 | 170.575 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 0.78 | -35.15 | 1 | 3 | -1 | 56 | 170.575 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 1.13 | -38.86 | 1 | 3 | -1 | 56 | 170.575 | 1 | ↓ |
