| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2012 | 16 | Yes |
Popular Name: tert-Butyl 3-amino-4-hydroxyazepane-1-carboxylate tert-Butyl 3-amino-4-hydroxyazep…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 198419-20-4 , N/A
| 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) | 0.00 | 1.07 | -40.12 | 4 | 5 | 1 | 77 | 231.316 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.00 | 0.87 | -5.93 | 3 | 5 | 0 | 76 | 230.308 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5902882; US6069245 | IBM Patent Data |
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