| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 25th, 2008 | 23 | 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) | 4.70 | 8.31 | -13.37 | 2 | 4 | 0 | 62 | 312.413 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.70 | 9.32 | -60.24 | 1 | 4 | -1 | 65 | 311.405 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.70 | 9.58 | -61.15 | 1 | 4 | -1 | 65 | 311.405 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
