| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 28th, 2008 | 18 | 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) | 4.02 | 5.47 | -9.68 | 1 | 3 | 0 | 45 | 301.143 | 1 | ↓ |
| Ref Reference (pH 7) | 4.02 | 5.76 | -8.31 | 1 | 3 | 0 | 45 | 301.143 | 1 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 3.99 | -41.53 | 0 | 3 | -1 | 48 | 300.135 | 1 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 3.47 | -45.78 | 0 | 3 | -1 | 48 | 300.135 | 1 | ↓ |
