| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 21 | 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) | 0.08 | 8.44 | -59.6 | 3 | 5 | 1 | 70 | 299.435 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.08 | 8.33 | -40.65 | 2 | 5 | 0 | 66 | 298.427 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.08 | 6.47 | -28.05 | 2 | 5 | 0 | 69 | 298.427 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
