| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 17 | Yes |
Popular Name: [3-(azocan-1-ylmethyl)phenyl]methanamine [3-(azocan-1-ylmethyl)phenyl]met…
Find On: PubMed — Wikipedia — Google
CAS Number: 115174-13-5
| 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) | 2.82 | 7.42 | -98.71 | 4 | 2 | 2 | 32 | 234.387 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 7.03 | -34.24 | 3 | 2 | 1 | 30 | 233.379 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
