| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 20 | Yes |
Popular Name: (2S)-2-isopropyl-2-methyl-4-[methyl(4-pyridylmethyl)amino]-4-oxo-butanoic (2S)-2-isopropyl-2-methyl-4-[met…
| 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) | 1.03 | 8.01 | -62.69 | 0 | 5 | -1 | 73 | 277.344 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.03 | 5.56 | -8.83 | 1 | 5 | 0 | 71 | 278.352 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.03 | 8.47 | -64.71 | 1 | 5 | 0 | 75 | 278.352 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.03 | 6.02 | -37.24 | 2 | 5 | 1 | 72 | 279.36 | 6 | ↓ |
