| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2008 | 13 | Yes |
Popular Name: 3-Ethyl-1,5-dimethyl-3,7-diaza-bicyclo[3.3.1]-nonane 3-Ethyl-1,5-dimethyl-3,7-diaza-b…
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CAS Number: 917202-56-3
| 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) | 1.38 | 5.67 | -29.46 | 2 | 2 | 1 | 20 | 183.319 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 5.18 | -0.31 | 2 | 2 | 0 | 16 | 183.319 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
