| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 22 | No |
Popular Name: (1R,2S)-N-(cyanomethyl)-2-[2-(4-methylsulfanylphenyl)ethyl]cyclohexane-1-carboxamide (1R,2S)-N-(cyanomethyl)-2-[2-(4-…
| 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) | 4.11 | 9.59 | -9.2 | 1 | 3 | 0 | 53 | 316.47 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
