| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 13 | Yes |
Popular Name: N,N-Dimethyl-N'-pyridin-4-ylmethyl-ethane-1,2-diamine N,N-Dimethyl-N'-pyridin-4-ylmeth…
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CAS Number: 136469-84-6
| 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) | 0.24 | 4.78 | -119.49 | 3 | 3 | 2 | 34 | 181.283 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.24 | 0.94 | -3.85 | 1 | 3 | 0 | 28 | 179.267 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.24 | 3.46 | -38.7 | 2 | 3 | 1 | 29 | 180.275 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.24 | 2.31 | -44.62 | 2 | 3 | 1 | 33 | 180.275 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.24 | 3.89 | -80.44 | 3 | 3 | 2 | 31 | 181.283 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
