| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 21 | Yes |
Popular Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide N-[(1R)-1-cyano-1-cyclopropyl-et…
| 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) | 0.66 | -0.58 | -15.34 | 2 | 6 | 0 | 80 | 294.399 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.66 | 1.75 | -41.4 | 3 | 6 | 1 | 81 | 295.407 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
