| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 15 | Yes |
Popular Name: 2-Chloro-N-[2-(dimethylamino)ethyl]nicotinamide 2-Chloro-N-[2-(dimethylamino)eth…
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CAS Numbers: 1016674-02-4 , N/A , [1016674-02-4]
| 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) | 0.89 | 3.66 | -51.03 | 2 | 4 | 1 | 46 | 228.703 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.89 | 1.13 | -14.68 | 1 | 4 | 0 | 45 | 227.695 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
