| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 25 | Yes |
Popular Name: 4-cyano-N-methyl-N-[1-[2-(2-pyridyl)ethyl]-4-piperidyl]butane-1-sulfonamide 4-cyano-N-methyl-N-[1-[2-(2-pyri…
| 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) | 1.00 | 8.06 | -54.6 | 1 | 6 | 1 | 79 | 365.523 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.00 | 5.85 | -18.01 | 0 | 6 | 0 | 77 | 364.515 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
