In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 12 | Yes |
Popular Name: 3-[1-(ethylamino)ethyl]phenol hydrobromide 3-[1-(ethylamino)ethyl]phenol hy…
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CAS Numbers: 1017048-03-1 , 1170975-91-3
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) | 1.93 | 3.11 | -41.7 | 3 | 2 | 1 | 37 | 166.244 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 3.9 | -60.93 | 2 | 2 | 0 | 40 | 165.236 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |