| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 27 | 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) | 2.14 | 2.41 | -14.37 | 3 | 7 | 0 | 99 | 365.389 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 2.76 | -59.9 | 1 | 7 | -1 | 98 | 364.381 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 3.05 | -57.42 | 1 | 7 | -1 | 98 | 364.381 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 3.37 | -51.57 | 2 | 7 | -1 | 102 | 364.381 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 3.17 | -55.22 | 2 | 7 | -1 | 102 | 364.381 | 5 | ↓ |
