| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 13 | Yes |
Popular Name: 2-cyano-N-(pyridin-2-ylmethyl)acetamide 2-cyano-N-(pyridin-2-ylmethyl)ac…
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CAS Numbers: , 84951-58-6 , [84951-58-6]
| 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) | -0.90 | 2.15 | -16.73 | 1 | 4 | 0 | 66 | 175.191 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.90 | 2.42 | -49.22 | 2 | 4 | 1 | 67 | 176.199 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
