| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2008 | 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) | 5.89 | 7.97 | -8.34 | 2 | 5 | 0 | 78 | 383.86 | 1 | ↓ |
| Ref Reference (pH 7) | 5.89 | 7.54 | -8.2 | 2 | 5 | 0 | 78 | 383.86 | 1 | ↓ |
| Hi High (pH 8-9.5) | 5.86 | 5.55 | -102.85 | 0 | 5 | -2 | 80 | 381.844 | 2 | ↓ |
| Mid Mid (pH 6-8) | 6.35 | 5.58 | -43.23 | 1 | 5 | -1 | 81 | 382.852 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.35 | 5.71 | -44.89 | 1 | 5 | -1 | 81 | 382.852 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.35 | 6 | -43.24 | 1 | 5 | -1 | 81 | 382.852 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.35 | 6.4 | -42.56 | 1 | 5 | -1 | 81 | 382.852 | 1 | ↓ |
