| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2009 | 30 | 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) | 4.20 | 7.12 | -15.36 | 2 | 7 | 0 | 103 | 404.47 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.20 | 7.58 | -52.41 | 1 | 7 | -1 | 106 | 403.462 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.20 | 8.23 | -62.16 | 1 | 7 | -1 | 106 | 403.462 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.20 | 7.13 | -61.08 | 1 | 7 | -1 | 106 | 403.462 | 4 | ↓ |
