| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2006 | 23 | Yes |
Popular Name: N-(3-Chloro-phenyl)-2-(5-pyridin-3-yl-2H-[1,2,4]triazol-3-ylsulfanyl)-acetamide N-(3-Chloro-phenyl)-2-(5-pyridin…
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CAS Number: 332157-99-0
| 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) | 2.81 | 6.5 | -11.24 | 2 | 6 | 0 | 84 | 345.815 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 6.31 | -43.68 | 1 | 6 | -1 | 82 | 344.807 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.