| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 15 | 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) | 1.33 | 4.77 | -35.31 | 3 | 4 | 1 | 58 | 203.269 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 4.31 | -7.29 | 2 | 4 | 0 | 57 | 202.261 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.33 | 5.22 | -86.2 | 4 | 4 | 2 | 59 | 204.277 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
