| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 19 | Yes |
Popular Name: (2S)-4-[2-cyanoethyl(isopropyl)amino]-2-isopropyl-2-methyl-4-oxo-butanoic (2S)-4-[2-cyanoethyl(isopropyl)a…
| 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) | 1.05 | 8.58 | -57.87 | 0 | 5 | -1 | 84 | 267.349 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.05 | 6.67 | -13.28 | 1 | 5 | 0 | 81 | 268.357 | 7 | ↓ |
