| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 12 | Yes |
Popular Name: 1-amino-3-(1-azepanyl)-2-propanol 1-amino-3-(1-azepanyl)-2-propanol
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CAS Number: 953743-40-3
| 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) | -0.08 | 1.19 | -104.25 | 5 | 3 | 2 | 52 | 174.288 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.08 | 0.61 | -29.33 | 4 | 3 | 1 | 51 | 173.28 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
