| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 21 | Yes |
Popular Name: 1-[1-[3-(ethylamino)-3-oxo-propyl]-4-piperidyl]pyrrole-2-carboxylic 1-[1-[3-(ethylamino)-3-oxo-propy…
| 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) | 0.90 | 7.36 | -75.74 | 2 | 6 | 0 | 79 | 293.367 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 5.15 | -56.51 | 1 | 6 | -1 | 77 | 292.359 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
