| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 22 | No |
Popular Name: 1,3-dioxo-N-(3-pyridylmethyl)isoindoline-5-sulfonamide 1,3-dioxo-N-(3-pyridylmethyl)iso…
| 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) | 0.66 | -0.41 | -15.72 | 2 | 7 | 0 | 109 | 317.326 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.81 | -3.04 | -49.07 | 1 | 7 | -1 | 112 | 316.318 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.66 | -0.8 | -39.97 | 1 | 7 | -1 | 111 | 316.318 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
