| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2009 | 14 | Yes |
Popular Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethane-1,2-diamine 1-(2,3-dihydro-1,4-benzodioxin-6…
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CAS Numbers: 1089349-42-7 , 1427380-97-9
(1S)-1-(2,3-DIHYDRO-1,4-BENZODIOXIN-7-YL)ETHANE-1,2-DIAMINE
1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethane-1,2-diamine dihydrochloride
| 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) | -2.26 | -0.35 | -45.02 | 5 | 4 | 1 | 72 | 195.242 | 2 | ↓ |
| Mid Mid (pH 6-8) | -2.26 | 0.04 | -140.27 | 6 | 4 | 2 | 74 | 196.25 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
