| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 20th, 2008 | 31 | 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) | 1.77 | 4.6 | -63.74 | 0 | 8 | -1 | 95 | 425.461 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 5.92 | -57.57 | 2 | 8 | 1 | 94 | 427.477 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 6.96 | -60.9 | 1 | 8 | 1 | 90 | 427.477 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 7.01 | -73.96 | 1 | 8 | 0 | 96 | 426.469 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 3.78 | -19.69 | 1 | 8 | 0 | 92 | 426.469 | 7 | ↓ |
