| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 12 | Yes |
Popular Name: 1-Ethyl-2-isopropyl-1,4-diazepane dihydrochloride 1-Ethyl-2-isopropyl-1,4-diazepan…
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CAS Numbers: , 1185021-25-3 , [1185021-25-3]
1-ethyl-2-isopropyl-1,4-diazepanedihydrochloride
1H-1,4-diazepine, 1-ethylhexahydro-2-(1-methylethyl)-, 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) | 1.39 | 3.25 | -36.19 | 2 | 2 | 1 | 20 | 171.308 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.39 | 5.06 | -103.34 | 3 | 2 | 2 | 21 | 172.316 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
