| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 13 | 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) | 0.15 | 2.25 | -36.51 | 3 | 3 | 1 | 36 | 180.275 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.15 | 1.05 | -3.68 | 2 | 3 | 0 | 31 | 179.267 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.15 | 3.13 | -28.32 | 3 | 3 | 1 | 32 | 180.275 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
