| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: 4-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]pyridin-3-amine 4-[[4-(trifluoromethoxy)phenyl]m…
| 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) | 3.28 | 5.37 | -6.11 | 2 | 3 | 0 | 48 | 300.305 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.28 | 5.83 | -35.25 | 3 | 3 | 1 | 49 | 301.313 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
