| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 25 | 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) | 3.44 | 5.66 | -32.59 | 4 | 6 | 1 | 94 | 344.435 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 3.34 | -10.66 | 3 | 6 | 0 | 93 | 343.427 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.26 | 5.46 | -27.67 | 3 | 6 | 0 | 100 | 343.427 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
