| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 18 | 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) | 1.49 | 4.45 | -40.75 | 4 | 5 | 1 | 81 | 242.306 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 4.62 | -90.44 | 5 | 5 | 2 | 82 | 243.314 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 4.62 | -90.42 | 5 | 5 | 2 | 82 | 243.314 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
