| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 21 | Yes |
Popular Name: 2-[[3-cyano-6-(4-pyridyl)-2-pyridyl]thio]acetic-acid-ethyl-ester 2-[[3-cyano-6-(4-pyridyl)-2-pyri…
| 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) | 2.18 | 7.84 | -13.17 | 0 | 5 | 0 | 76 | 299.355 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | 8.3 | -51.16 | 1 | 5 | 1 | 77 | 300.363 | 6 | ↓ |
