| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 14 | Yes |
Popular Name: (2S)-3-[ethyl-(4-methylthiazol-2-yl)amino]-2-methyl-propanenitrile (2S)-3-[ethyl-(4-methylthiazol-2…
| 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) | 2.22 | 6.76 | -8.14 | 0 | 3 | 0 | 40 | 209.318 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.22 | 7.17 | -31.75 | 1 | 3 | 1 | 41 | 210.326 | 4 | ↓ |
