| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 13 | Yes |
Popular Name: N,N-Dimethyl-N'-pyridin-2-ylmethyl-ethane-1,2-diamine N,N-Dimethyl-N'-pyridin-2-ylmeth…
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CAS Number: 133280-80-5
| 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) | 0.36 | 4.72 | -109.05 | 3 | 3 | 2 | 34 | 181.283 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.36 | 0.88 | -3.8 | 1 | 3 | 0 | 28 | 179.267 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | 3.4 | -35.26 | 2 | 3 | 1 | 29 | 180.275 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | 2.26 | -37.32 | 2 | 3 | 1 | 33 | 180.275 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.36 | 3.77 | -83.13 | 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 |
