In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2010 | 17 | Yes |
Popular Name: octahydro-pyrrolo[3,4-d]azepine-6-carboxylicacidtert-butylester octahydro-pyrrolo[3,4-d]azepine-…
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CAS Number: 125272-33-0
2-BOC-OCTAHYDRO-PYRROLO[3,4-D]AZEPINE
Octahydro-pyrrolo[3,4-d]azepine-2-carboxylic acid tert-butyl ester
None
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) | 1.82 | 5.23 | -46.48 | 2 | 4 | 1 | 46 | 241.355 | 2 | ↓ |