| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2010 | 18 | Yes |
Popular Name: N-[2-(2-chlorophenyl)ethyl]-5-oxo-1,2-dihydro-1,2,4-triazole-3-carboxamide N-[2-(2-chlorophenyl)ethyl]-5-ox…
| 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) | 0.77 | 1.9 | -9.7 | 3 | 6 | 0 | 91 | 266.688 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.23 | -0.65 | -47.35 | 2 | 6 | -1 | 94 | 265.68 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.23 | 0.44 | -24.21 | 3 | 6 | 0 | 95 | 266.688 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
