| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 16 | Yes |
Popular Name: (2S)-2-methyl-3-(4-thiazol-2-ylpiperazin-1-yl)propanenitrile (2S)-2-methyl-3-(4-thiazol-2-ylp…
| 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 | 5.05 | -9.46 | 0 | 4 | 0 | 43 | 236.344 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 6.89 | -49.13 | 1 | 4 | 1 | 44 | 237.352 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.52 | 7.33 | -99.21 | 2 | 4 | 2 | 46 | 238.36 | 3 | ↓ |
