| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 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) | 2.52 | 3.48 | -42.46 | 3 | 2 | 1 | 31 | 211.373 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 5.37 | -32.01 | 3 | 2 | 1 | 30 | 211.373 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 5.69 | -107.66 | 4 | 2 | 2 | 32 | 212.381 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
