| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 3rd, 2011 | 19 | Yes |
Popular Name: 3,4-dichloro-N-(5-isopropyl-4H-1,2,4-triazol-3-yl)benzamide 3,4-dichloro-N-(5-isopropyl-4H-1…
| 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) | 3.03 | 7.92 | -46.9 | 1 | 5 | -1 | 69 | 298.153 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 6.62 | -41.73 | 1 | 5 | -1 | 77 | 298.153 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 8.17 | -12.78 | 2 | 5 | 0 | 71 | 299.161 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
