| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 15 | Yes |
Popular Name: 2-{[2-(dimethylamino)ethyl]thio}nicotinic acid 2-{[2-(dimethylamino)ethyl]thio}…
| 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) | 1.19 | 5.76 | -65.28 | 1 | 4 | 0 | 57 | 226.301 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.19 | 3.23 | -49.43 | 0 | 4 | -1 | 56 | 225.293 | 5 | ↓ |
