| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 16 | Yes |
Popular Name: (2S)-2-cyano-3-methyl-N-[(3S)-1-methyl-3-piperidyl]butanamide (2S)-2-cyano-3-methyl-N-[(3S)-1-…
| 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) | 1.87 | 5.32 | -41.03 | 2 | 4 | 1 | 57 | 224.328 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.06 | 3.29 | -37.62 | 1 | 4 | 0 | 64 | 223.32 | 3 | ↓ |
