| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 36 | 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) | 5.22 | 10.26 | -13.53 | 2 | 7 | 0 | 88 | 503.986 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.99 | 10.3 | -60.52 | 0 | 7 | -1 | 87 | 502.978 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.99 | 9.75 | -53.57 | 0 | 7 | -1 | 87 | 502.978 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.22 | 11.31 | -46.53 | 1 | 7 | -1 | 91 | 502.978 | 6 | ↓ |
