| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 19 | Yes |
Popular Name: (1S,2R,4S)-2-[methyl(thiazol-4-ylmethyl)amino]-4-propyl-cyclohexanecarbonitrile (1S,2R,4S)-2-[methyl(thiazol-4-y…
| 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) | 3.72 | 8.23 | -45.98 | 1 | 3 | 1 | 41 | 278.445 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.72 | 6.18 | -11.62 | 0 | 3 | 0 | 40 | 277.437 | 5 | ↓ |
