| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2010 | 18 | Yes |
Popular Name: (1S,2R,4R)-4-methyl-2-[methyl-[(2-methylthiazol-4-yl)methyl]amino]cyclohexanecarbonitrile (1S,2R,4R)-4-methyl-2-[methyl-[(…
| 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) | 2.19 | 7.82 | -46.41 | 1 | 3 | 1 | 41 | 264.418 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 5.78 | -12.43 | 0 | 3 | 0 | 40 | 263.41 | 3 | ↓ |
