| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 9th, 2011 | 19 | 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) | 3.33 | 8.59 | -43.06 | 2 | 2 | 1 | 26 | 298.497 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 7.36 | -4.85 | 1 | 2 | 0 | 21 | 297.489 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
