| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 31 | 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) | 3.94 | 7.23 | -13.12 | 2 | 7 | 0 | 88 | 421.497 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 7.79 | -47.68 | 0 | 7 | -1 | 87 | 420.489 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 7.59 | -56.93 | 0 | 7 | -1 | 87 | 420.489 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.94 | 8.35 | -41.94 | 1 | 7 | -1 | 91 | 420.489 | 7 | ↓ |
