| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 15 | 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) | -0.13 | 8.32 | -103.83 | 2 | 4 | 2 | 41 | 209.293 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.13 | 5.6 | -10.77 | 0 | 4 | 0 | 38 | 207.277 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.13 | 7.81 | -55.34 | 1 | 4 | 1 | 39 | 208.285 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.13 | 6.11 | -37.85 | 1 | 4 | 1 | 39 | 208.285 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
