In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (2S,4S)-N-(2-cyanoethyl)-4-hydroxy-N-(2-morpholinoethyl)pyrrolidine-2-carboxamide (2S,4S)-N-(2-cyanoethyl)-4-hydro…
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) | -1.74 | -0.72 | -52.83 | 3 | 7 | 1 | 93 | 297.379 | 6 | ↓ |
Mid Mid (pH 6-8) | -1.74 | 1.55 | -107.3 | 4 | 7 | 2 | 95 | 298.387 | 6 | ↓ |