| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 16 | 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) | 2.82 | 5.42 | -9.21 | 1 | 3 | 0 | 38 | 217.247 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 5.61 | -29.92 | 2 | 3 | 1 | 39 | 218.255 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 5.56 | -27.89 | 2 | 3 | 1 | 39 | 218.255 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
