| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 25 | Yes |
Popular Name: N-(2-cyanoethyl)-N-(2-pyridylmethyl)-2-[3-(trifluoromethyl)phenyl]acetamide N-(2-cyanoethyl)-N-(2-pyridylmet…
| 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) | 2.02 | 10.03 | -15.13 | 0 | 4 | 0 | 57 | 347.34 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.02 | 10.51 | -44.27 | 1 | 4 | 1 | 58 | 348.348 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
