| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: (3S)-1-[2-(2,5-dichlorophenyl)sulfanylethyl]-3-ethyl-pyrrolidine-3-carboxylic (3S)-1-[2-(2,5-dichlorophenyl)su…
| 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) | 4.01 | 11.35 | -45.11 | 1 | 3 | 0 | 45 | 348.295 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.01 | 8.81 | -46.7 | 0 | 3 | -1 | 43 | 347.287 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[2-(phenylthio)ethyl]pyrrolidine](http://zinc12.docking.org/img/rings/9378.gif)