| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 24 | 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) | 3.07 | 10.02 | -105.96 | 3 | 4 | 2 | 40 | 334.504 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 8.01 | -43.76 | 2 | 4 | 1 | 38 | 333.496 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 8.66 | -34.41 | 2 | 4 | 1 | 35 | 333.496 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
