In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 19 | Yes |
Popular Name: tert-butyl 1-methyl-1,4,9-triazaspiro[5.5]undecane-9-carboxylate tert-butyl 1-methyl-1,4,9-triaza…
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CAS Number: 1308384-37-3
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) | 1.16 | 3.1 | -46.95 | 2 | 5 | 1 | 49 | 270.397 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.16 | 1.72 | -4.98 | 1 | 5 | 0 | 45 | 269.389 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.