| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 16 | Yes |
Popular Name: (3S)-3-[(3-bromo-2-thienyl)methyl]piperidine-3-carboxylic (3S)-3-[(3-bromo-2-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) | 1.91 | 6.53 | -37.87 | 2 | 3 | 0 | 57 | 304.209 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 5 | -37.39 | 1 | 3 | -1 | 52 | 303.201 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
