| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 16 | Yes |
Popular Name: (3S)-1-[(5-bromo-3-thienyl)methyl]-3-methyl-pyrrolidine-3-carboxylic (3S)-1-[(5-bromo-3-thienyl)methy…
| 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) | 2.25 | 8.27 | -48.04 | 1 | 3 | 0 | 45 | 304.209 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 5.72 | -42.97 | 0 | 3 | -1 | 43 | 303.201 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
