| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 2011 | 25 | Yes |
Popular Name: 2-(dimethylamino)-N-[[3-(2-dimethylaminoethyloxy)phenyl]methyl]pyridine-4-carboxamide 2-(dimethylamino)-N-[[3-(2-dimet…
| 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) | 1.75 | 8.19 | -44.07 | 2 | 6 | 1 | 59 | 343.451 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 5.66 | -10.68 | 1 | 6 | 0 | 58 | 342.443 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.75 | 8.51 | -81.33 | 3 | 6 | 2 | 60 | 344.459 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
