| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 15 | Yes |
Popular Name: 1-(4-methylbenzyl)-1,4-diazepane 1-(4-methylbenzyl)-1,4-diazepane
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CAS Number: 110766-00-2
| 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) | 1.76 | 5.88 | -30.87 | 2 | 2 | 1 | 16 | 205.325 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 4.74 | -36.78 | 2 | 2 | 1 | 20 | 205.325 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |