| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 17 | 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) | 0.67 | 1.66 | -29.37 | 3 | 5 | 1 | 56 | 237.327 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.67 | 1.19 | -6.29 | 2 | 5 | 0 | 55 | 236.319 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.67 | 3.96 | -81.87 | 4 | 5 | 2 | 57 | 238.335 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
