| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2010 | 13 | Yes |
Popular Name: 2-bromo-6-{[(propan-2-yl)amino]methyl}phenol 2-bromo-6-{[(propan-2-yl)amino]m…
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CAS Number: 157729-12-9
| 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) | 2.66 | 3.66 | -37.24 | 3 | 2 | 1 | 37 | 245.14 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.66 | 4.42 | -30.16 | 2 | 2 | 0 | 40 | 244.132 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
