| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2011 | 22 | Yes |
Popular Name: [(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-(1H-triazol-4-yl)methanone [(2S)-2-(2,5-dimethoxyphenyl)pyr…
| 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) | 1.49 | 3.91 | -11.71 | 1 | 7 | 0 | 80 | 302.334 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 3.89 | -46.36 | 0 | 7 | -1 | 79 | 301.326 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
