| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 24 | Yes |
Popular Name: N-[6-(diethylamino)-3-pyridyl]-1,3-dihydroisobenzofuran-5-sulfonamide N-[6-(diethylamino)-3-pyridyl]-1…
| 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) | 2.54 | 5.39 | -11.7 | 1 | 6 | 0 | 72 | 347.44 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 5.79 | -24.65 | 1 | 6 | 0 | 75 | 347.44 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 5.41 | -48.97 | 0 | 6 | -1 | 74 | 346.432 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
