| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2011 | 21 | Yes |
Popular Name: methyl-5-[(E)-2-(dimethylamino)vinyl]-1-(4-fluorophenyl)-1H-1,2,3-triazole-4-carboxylate methyl-5-[(E)-2-(dimethylamino)v…
| 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) | 1.84 | 6.55 | -8.79 | 0 | 6 | 0 | 60 | 290.298 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.55 | -9.06 | 0 | 6 | 0 | 60 | 290.298 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.