| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 15 | 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) | 0.07 | 0.63 | -8.82 | 1 | 5 | 0 | 50 | 208.265 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.07 | 0.8 | -34.17 | 2 | 5 | 1 | 52 | 209.273 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.07 | 2.91 | -47.72 | 2 | 5 | 1 | 51 | 209.273 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.07 | 0.81 | -31.57 | 2 | 5 | 1 | 52 | 209.273 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
