| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2010 | 21 | Yes |
Popular Name: (3S)-1-(2-cyanoethyl)-N,N-diisobutyl-piperidine-3-carboxamide (3S)-1-(2-cyanoethyl)-N,N-diisob…
| 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) | 2.17 | 9.85 | -53.08 | 1 | 4 | 1 | 49 | 294.463 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 7.62 | -11.24 | 0 | 4 | 0 | 47 | 293.455 | 7 | ↓ |
