In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 13 | Yes |
Popular Name: [(5-bromo-2-fluorophenyl)methyl](prop-2-en-1-yl)amine [(5-bromo-2-fluorophenyl)methyl]…
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CAS Number: 1019484-07-1
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) | 3.04 | 6.46 | -37.87 | 2 | 1 | 1 | 17 | 245.115 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 5.05 | -2.4 | 1 | 1 | 0 | 12 | 244.107 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |