| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2009 | 18 | Yes |
Popular Name: (2S)-1-[3-[2-cyanoethyl(methyl)amino]-3-oxo-propyl]pyrrolidine-2-carboxamide (2S)-1-[3-[2-cyanoethyl(methyl)a…
| 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) | -0.90 | 3.09 | -46.83 | 3 | 6 | 1 | 92 | 253.326 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.14 | 1.59 | -42.99 | 2 | 6 | 0 | 95 | 252.318 | 6 | ↓ |
