| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 19 | Yes |
Popular Name: 1-[(3R)-2,5-dioxopyrrolidin-3-yl]-4-propyl-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) | 0.23 | 1.84 | -69.2 | 1 | 6 | -1 | 97 | 267.305 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.23 | -0.58 | -92.24 | 0 | 6 | -2 | 96 | 266.297 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.05 | 4.4 | -67.83 | 2 | 6 | 0 | 91 | 268.313 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.05 | 1.98 | -49.17 | 1 | 6 | -1 | 90 | 267.305 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
