| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2011 | 12 | No |
Popular Name: Ethyl (2E)-3-(3-chloro-1H-1,2,4-triazol-5-yl)-2-propenoate Ethyl (2E)-3-(3-chloro-1H-1,2,4-…
None
| 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) | 0.90 | 3.22 | -33.47 | 0 | 5 | -1 | 66 | 186.578 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 3.41 | -7.06 | 1 | 5 | 0 | 68 | 187.586 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
