| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 15 | Yes |
Popular Name: (1S,4S)-tert-Butyl 2,5-diazabicyclo[2.2.2]octane-2-carboxylate hydrochloride (1S,4S)-tert-Butyl 2,5-diazabicy…
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CAS Numbers: 858671-91-7 , 944086-67-3 , [944086-67-3]
| 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) | 1.40 | 4.2 | -46.22 | 2 | 4 | 1 | 46 | 213.301 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 2.93 | -6.18 | 1 | 4 | 0 | 42 | 212.293 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.