| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 25th, 2008 | 9 | Yes |
Popular Name: 1,3-dimethyl-1,4-diazepane 1,3-dimethyl-1,4-diazepane
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CAS Number: 342614-29-3
(3R)-1,3-dimethyl-1,4-diazepane
(3R)-1,3-dimethyl-1,4-diazepane dihydrochloride
1,3-dimethyl-1,4-diazepane 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) | 0.59 | 1.78 | -33.52 | 2 | 2 | 1 | 20 | 129.227 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | 2.58 | -29.95 | 2 | 2 | 1 | 16 | 129.227 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.59 | 3.74 | -100.86 | 3 | 2 | 2 | 21 | 130.235 | 0 | ↓ |
