| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2012 | 14 | Yes |
Popular Name: 1-{3-[Ethyl-(2-hydroxy-ethyl)-amino]-pyrrolidin-1-yl}-ethanone 1-{3-[Ethyl-(2-hydroxy-ethyl)-am…
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CAS Number: 1353944-39-4
| 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) | -0.40 | 1.69 | -38.61 | 2 | 4 | 1 | 45 | 201.29 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.40 | -0.41 | -11.33 | 1 | 4 | 0 | 44 | 200.282 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.