| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2008 | 27 | No |
Popular Name: 2-[5-(4-Methoxy-phenyl)-2H-[1,2,4]triazol-3-ylsulfanyl]-N-(4-nitro-phenyl)-acetamide 2-[5-(4-Methoxy-phenyl)-2H-[1,2,…
Find On: PubMed — Wikipedia — Google
CAS Number: 337498-41-6
| 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) | 3.25 | 7.74 | -27.3 | 2 | 9 | 0 | 126 | 385.405 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.25 | 7.58 | -47.45 | 1 | 9 | -1 | 124 | 384.397 | 7 | ↓ |
