| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: (2S,3R)-2-amino-N-(2-cyanoethyl)-3-methyl-N-(2-morpholinoethyl)pentanamide (2S,3R)-2-amino-N-(2-cyanoethyl)…
| 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) | -0.51 | 2.51 | -53.02 | 3 | 6 | 1 | 84 | 297.423 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.51 | 2.17 | -12.13 | 2 | 6 | 0 | 83 | 296.415 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.51 | 4.78 | -112.22 | 4 | 6 | 2 | 85 | 298.431 | 8 | ↓ |
