In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 25 | Yes |
Popular Name: 6-(2-diethylaminoethylsulfanyl)-N-(4-ethylphenyl)pyridine-3-carboxamide 6-(2-diethylaminoethylsulfanyl)-…
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) | 4.23 | 11.09 | -43.82 | 2 | 4 | 1 | 46 | 358.531 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.23 | 8.85 | -9.29 | 1 | 4 | 0 | 45 | 357.523 | 9 | ↓ |