| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 25 | Yes |
Popular Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-tert-butyl-4-(trifluoromethyl)pyridine-3-carbonitrile 2-[(4-chlorophenyl)methylsulfany…
| 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) | 6.60 | 4.66 | -6.61 | 0 | 2 | 0 | 36 | 384.854 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 6.60 | 4.79 | -39.77 | 1 | 2 | 1 | 37 | 385.862 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
