| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 32 | No |
None
| 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) | 1.55 | 7.11 | -97.75 | 4 | 9 | 2 | 91 | 444.58 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | 2.62 | -54.02 | 2 | 9 | 0 | 96 | 442.564 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 4.89 | -54.4 | 3 | 9 | 1 | 89 | 443.572 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 4.83 | -72.73 | 3 | 9 | 1 | 97 | 443.572 | 5 | ↓ |
