| 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) | 3.10 | 5.55 | -34.99 | 2 | 3 | 1 | 39 | 224.646 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 6.1 | -39.06 | 2 | 3 | 1 | 39 | 224.646 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 5.93 | -11.45 | 1 | 3 | 0 | 38 | 223.638 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
