In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 13 | Yes |
Popular Name: 2-bromo-6-{[(2-hydroxyethyl)amino]methyl}phenol 2-bromo-6-{[(2-hydroxyethyl)amin…
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CAS Number: 1167416-80-9
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) | 1.36 | -0.13 | -38.24 | 4 | 3 | 1 | 57 | 247.112 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.36 | 0.71 | -33.57 | 3 | 3 | 0 | 60 | 246.104 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |