| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 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) | -0.69 | 0.52 | -9.67 | 2 | 7 | 0 | 90 | 211.225 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.69 | 1.82 | -50.7 | 3 | 7 | 1 | 95 | 212.233 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.69 | 2.78 | -98.71 | 4 | 7 | 2 | 96 | 213.241 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
