| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 16 | Yes |
Popular Name: 2-(1H-imidazol-1-yl)-1,2,3,4-tetrahydronaphthalen-1-amine 2-(1H-imidazol-1-yl)-1,2,3,4-tet…
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CAS Number: 1042771-99-2
| 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) | -0.39 | 6.28 | -52.58 | 3 | 3 | 1 | 45 | 214.292 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.39 | 5.95 | -7.78 | 2 | 3 | 0 | 44 | 213.284 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.39 | 6.76 | -111.26 | 4 | 3 | 2 | 47 | 215.3 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| MP | 93 - 95 | Enamine Building Blocks |
| MP | 93...95 | Enamine Building Blocks |
| purity | 95 | Enamine Building Blocks |
