| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 13 | Yes |
Popular Name: 1-(2,2-dimethylpropanoyl)-1,4-diazepane 1-(2,2-dimethylpropanoyl)-1,4-di…
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CAS Number: 926198-21-2
| 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) | 0.93 | 3.97 | -47.64 | 2 | 3 | 1 | 37 | 185.291 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | 2.59 | -8.7 | 1 | 3 | 0 | 32 | 184.283 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| MP | 98 - 100 | Enamine Building Blocks |
| MP | 98...100 | Enamine Building Blocks |
