| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 15 | Yes |
Popular Name: [(2,6-difluorophenyl)methyl][2-(dimethylamino)ethyl]amine [(2,6-difluorophenyl)methyl][2-(…
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CAS Number: 953891-59-3
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) | 1.76 | 4.16 | -34.61 | 2 | 2 | 1 | 20 | 215.267 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.76 | 2.75 | -3.65 | 1 | 2 | 0 | 15 | 214.259 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 5.29 | -33.78 | 2 | 2 | 1 | 16 | 215.267 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 6.59 | -104.49 | 3 | 2 | 2 | 21 | 216.275 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
