| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 25 | 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) | 1.32 | 5.35 | -41.13 | 3 | 6 | 1 | 70 | 347.483 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.32 | 2.98 | -11.62 | 2 | 6 | 0 | 68 | 346.475 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.32 | 5.24 | -39.82 | 3 | 6 | 1 | 70 | 347.483 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
