| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 11 | Yes |
Popular Name: 1-(3-Bromophenyl)-2-fluoroethanamine 1-(3-Bromophenyl)-2-fluoroethana…
Find On: PubMed — Wikipedia — Google
CAS Number: 929972-40-7
| 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) | 0.51 | 3.98 | -47.74 | 3 | 1 | 1 | 28 | 219.077 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.51 | 3.68 | -2.35 | 2 | 1 | 0 | 26 | 218.069 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.