| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | No |
Popular Name: 5-chloro-6-(1,4-thiazepan-4-yl)pyridine-3-carboxylic 5-chloro-6-(1,4-thiazepan-4-yl)p…
| 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) | 1.98 | 7.92 | -41.2 | 0 | 4 | -1 | 56 | 271.749 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.98 | 8.37 | -32.38 | 1 | 4 | 0 | 58 | 272.757 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
