| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 16 | No |
Popular Name: 3-(3-Methoxybenzyl)pyrrolidine-2,5-dione 3-(3-Methoxybenzyl)pyrrolidine-2…
Find On: PubMed — Wikipedia — Google
CAS Number: 1267618-58-5
| 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) | 1.08 | 2.93 | -13.25 | 1 | 4 | 0 | 55 | 219.24 | 3 | ↓ |
| Ref Reference (pH 7) | 1.08 | 2.92 | -10.8 | 1 | 4 | 0 | 55 | 219.24 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 0.38 | -47.33 | 0 | 4 | -1 | 62 | 218.232 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 0.38 | -42.72 | 0 | 4 | -1 | 62 | 218.232 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.
