| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 26 | No |
| 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) | 6.52 | 8.4 | -8.09 | 2 | 5 | 0 | 78 | 495.729 | 1 | ↓ |
| Ref Reference (pH 7) | 6.52 | 7.97 | -8.92 | 2 | 5 | 0 | 78 | 495.729 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.98 | 6.16 | -44.32 | 1 | 5 | -1 | 81 | 494.721 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.98 | 6.03 | -41.51 | 1 | 5 | -1 | 81 | 494.721 | 1 | ↓ |
| Mid Mid (pH 6-8) | 7.44 | 4.87 | -101.72 | 0 | 5 | -2 | 84 | 493.713 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.98 | 6.85 | -43.17 | 1 | 5 | -1 | 81 | 494.721 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.98 | 6.43 | -38.78 | 1 | 5 | -1 | 81 | 494.721 | 1 | ↓ |
| Mid Mid (pH 6-8) | 7.44 | 4.2 | -104.55 | 0 | 5 | -2 | 84 | 493.713 | 1 | ↓ |
