| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 21 | Yes |
Popular Name: (3S)-3-amino-1-[(3,5-dimethylbenzofuran-2-yl)methyl]pyrrolidine-3-carboxylic (3S)-3-amino-1-[(3,5-dimethylben…
| 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) | -0.03 | 7.27 | -82.19 | 4 | 5 | 1 | 85 | 289.355 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.03 | 4.8 | -42.06 | 3 | 5 | 0 | 84 | 288.347 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
