| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 18 | 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) | -0.95 | 5.67 | -39.87 | 2 | 6 | 0 | 87 | 246.27 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.95 | 4.43 | -50.1 | 1 | 6 | -1 | 83 | 245.262 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
