| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 17 | Yes |
Popular Name: (1S,2R,4S)-4-ethyl-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]cyclohexanecarbonitrile (1S,2R,4S)-4-ethyl-2-[(5-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) | 2.65 | 7.32 | -9.16 | 1 | 4 | 0 | 65 | 250.371 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
