In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 5th, 2011 | 23 | Yes |
Popular Name: (3R)-N-[2-(2-cyano-3-fluoro-anilino)ethyl]-1-ethyl-5-oxo-pyrrolidine-3-carboxamide (3R)-N-[2-(2-cyano-3-fluoro-anil…
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) | 0.95 | 4.54 | -20.51 | 2 | 6 | 0 | 85 | 318.352 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.