| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2008 | 13 | Yes |
Popular Name: [5-bromo-2-(difluoromethoxy)phenyl]methanamine hydrochloride [5-bromo-2-(difluoromethoxy)phen…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1039920-79-0 , 1235441-60-7
| 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) | 2.47 | 2.77 | -48.01 | 3 | 2 | 1 | 37 | 253.066 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 2.37 | -5.11 | 2 | 2 | 0 | 35 | 252.058 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 226 - 228 | Enamine Building Blocks |
| MP | 226...228 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
