| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 16 | Yes |
Popular Name: (2S,3R)-2-amino-N-(2-cyanoethyl)-N-isopropyl-3-methyl-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) | 0.28 | 4.32 | -50 | 3 | 4 | 1 | 72 | 226.344 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.28 | 4 | -9.75 | 2 | 4 | 0 | 70 | 225.336 | 6 | ↓ |
