| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 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) | 1.88 | 0.94 | -15.2 | 4 | 7 | 0 | 110 | 365.389 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 1.72 | -45.65 | 2 | 7 | -1 | 109 | 364.381 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 1.25 | -54.43 | 2 | 7 | -1 | 109 | 364.381 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 1.76 | -39.74 | 3 | 7 | -1 | 113 | 364.381 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 1.7 | -54.19 | 3 | 7 | -1 | 113 | 364.381 | 5 | ↓ |
