| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 22nd, 2010 | 16 | Yes |
Popular Name: (2S)-2-cyano-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]butanamide (2S)-2-cyano-N-[[(2S)-1-ethylpyr…
| 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) | 1.25 | 4.95 | -39.46 | 2 | 4 | 1 | 57 | 224.328 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 2.91 | -34.04 | 1 | 4 | 0 | 64 | 223.32 | 5 | ↓ |
