| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 13 | Yes |
Popular Name: (2S)-2-methyl-3-[methyl-(4-methylthiazol-2-yl)amino]propanenitrile (2S)-2-methyl-3-[methyl-(4-methy…
| 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) | 1.85 | 5.42 | -8.36 | 0 | 3 | 0 | 40 | 195.291 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.85 | 5.84 | -32.16 | 1 | 3 | 1 | 41 | 196.299 | 3 | ↓ |
