| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-4-[[2-(dimethylamino)-3-pyridyl]amino]-2-isopropyl-2-methyl-4-oxo-butanoic (2S)-4-[[2-(dimethylamino)-3-pyr…
| 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) | 1.52 | 7.45 | -56.65 | 1 | 6 | -1 | 85 | 292.359 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 7.82 | -59.22 | 2 | 6 | 0 | 87 | 293.367 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.52 | 5.99 | -32.65 | 3 | 6 | 1 | 84 | 294.375 | 6 | ↓ |
