| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 37 | 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) | 4.97 | 8.33 | -15.61 | 3 | 8 | 0 | 108 | 519.985 | 7 | ↓ |
| Ref Reference (pH 7) | 4.97 | 7.53 | -14.24 | 3 | 8 | 0 | 108 | 519.985 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.95 | 8.09 | -49.77 | 1 | 8 | -1 | 107 | 518.977 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.95 | 7.7 | -51.99 | 1 | 8 | -1 | 107 | 518.977 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.97 | 8.53 | -36.88 | 2 | 8 | -1 | 111 | 518.977 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.97 | 8.3 | -50.9 | 2 | 8 | -1 | 111 | 518.977 | 7 | ↓ |
