| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 29 | 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) | 3.99 | 6.26 | -15.81 | 3 | 6 | 0 | 89 | 456.34 | 5 | ↓ |
| Ref Reference (pH 7) | 3.99 | 6.21 | -13.16 | 3 | 6 | 0 | 89 | 456.34 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.99 | 7.01 | -43.91 | 2 | 6 | -1 | 92 | 455.332 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 6.03 | -57.68 | 1 | 6 | -1 | 88 | 455.332 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 6.01 | -51.47 | 1 | 6 | -1 | 88 | 455.332 | 5 | ↓ |
