| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 14 | No |
| 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) | 2.57 | 2.16 | -39.79 | 0 | 3 | -1 | 39 | 225.68 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 2.87 | -10.33 | 1 | 3 | 0 | 42 | 226.688 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
