| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 18 | Yes |
Popular Name: N-(4H-1,2,4-triazol-3-yl)-2-(trifluoromethyl)benzamide N-(4H-1,2,4-triazol-3-yl)-2-(tri…
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) | 1.45 | 7.23 | -19.18 | 2 | 5 | 0 | 71 | 256.187 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 7.04 | -52.34 | 1 | 5 | -1 | 69 | 255.179 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 7.32 | -46.15 | 1 | 5 | -1 | 77 | 255.179 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
