| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 15 | Yes |
Popular Name: 2-[2-(dimethylamino)ethyl]-2,3-dihydro-1H-isoindol-4-amine 2-[2-(dimethylamino)ethyl]-2,3-d…
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CAS Number: 1017388-40-7
None
| 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) | 0.79 | 3.43 | -37.25 | 3 | 3 | 1 | 34 | 206.313 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.79 | 0.86 | -3.54 | 2 | 3 | 0 | 32 | 205.305 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | 5.9 | -111.98 | 4 | 3 | 2 | 35 | 207.321 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | 3.41 | -38.13 | 3 | 3 | 1 | 34 | 206.313 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
