| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 18th, 2008 | 29 | 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) | 3.77 | 6.16 | -47.85 | 0 | 7 | -1 | 69 | 426.547 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.77 | 8.45 | -39.15 | 1 | 7 | 0 | 70 | 427.555 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.77 | 5.37 | -10 | 1 | 7 | 0 | 66 | 427.555 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.