| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 2nd, 2011 | 15 | Yes |
Popular Name: (3S)-3-[(2-ethylthiazol-4-yl)methyl-methyl-amino]butanenitrile (3S)-3-[(2-ethylthiazol-4-yl)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) | 0.98 | 4.62 | -9.9 | 0 | 3 | 0 | 40 | 223.345 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 6.64 | -39.4 | 1 | 3 | 1 | 41 | 224.353 | 5 | ↓ |
