| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 18 | Yes |
Popular Name: 1-[(3R)-2,5-dioxopyrrolidin-3-yl]-4-ethyl-piperidine-4-carboxylic 1-[(3R)-2,5-dioxopyrrolidin-3-yl…
| 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) | -0.33 | 1.08 | -55.51 | 1 | 6 | -1 | 97 | 253.278 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.33 | -1.35 | -108.74 | 0 | 6 | -2 | 96 | 252.27 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.51 | 3.65 | -47.27 | 2 | 6 | 0 | 91 | 254.286 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.51 | 1.21 | -50.56 | 1 | 6 | -1 | 90 | 253.278 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
