| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 13 | Yes |
Popular Name: [1-(2-bromophenyl)ethyl](propyl)amine [1-(2-bromophenyl)ethyl](propyl)…
Find On: PubMed — Wikipedia — Google
CAS Number: 1016812-00-2
| 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) | 3.70 | 7.27 | -38.45 | 2 | 1 | 1 | 17 | 243.168 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.70 | 6.18 | -2.23 | 1 | 1 | 0 | 12 | 242.16 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
