| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 14th, 2010 | 25 | No |
Popular Name: N-[4-(2-cyanophenoxy)phenyl]-2-thioxo-1H-pyridine-3-carboxamide N-[4-(2-cyanophenoxy)phenyl]-2-t…
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| 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) | 3.01 | 8.87 | -40.2 | 2 | 5 | 0 | 78 | 347.399 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 8.48 | -63.22 | 1 | 5 | -1 | 75 | 346.391 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
