| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2009 | 13 | Yes |
Popular Name: 1-amino-2-(4-bromophenyl)butan-2-ol 1-amino-2-(4-bromophenyl)butan-2-ol
Find On: PubMed — Wikipedia — Google
CAS Number: 1181734-60-0
| 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) | 1.83 | 2.25 | -50.3 | 4 | 2 | 1 | 48 | 245.14 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.83 | 1.95 | -4.9 | 3 | 2 | 0 | 46 | 244.132 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
