| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 11 | Yes |
Popular Name: N-[1-(aminomethyl)-2-ethylbutyl]-N,N-dimethylamine N-[1-(aminomethyl)-2-ethylbutyl]…
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CAS Number: 941400-59-5
| 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) | 1.26 | 1.69 | -38.17 | 3 | 2 | 1 | 31 | 159.297 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.26 | 4.01 | -28.35 | 3 | 2 | 1 | 30 | 159.297 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.26 | 3.52 | -117.03 | 4 | 2 | 2 | 32 | 160.305 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
