| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2014 | 21 | 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) | 1.94 | 9.37 | -42.95 | 2 | 4 | 1 | 50 | 282.367 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 8.9 | -12.9 | 1 | 4 | 0 | 49 | 281.359 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 8.9 | -13.12 | 1 | 4 | 0 | 49 | 281.359 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.