| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 21 | Yes |
Popular Name: 1-[(2S)-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]-3-propoxy-propan-1-one 1-[(2S)-2-(piperazine-1-carbonyl…
| 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) | -0.17 | 5.19 | -57.78 | 2 | 6 | 1 | 66 | 298.407 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.17 | 3.91 | -16.33 | 1 | 6 | 0 | 62 | 297.399 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
