In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2009 | 11 | No |
Popular Name: 1,2-Benzenediol, 4-ethyl-3-fluoro- 1,2-Benzenediol, 4-ethyl-3-fluoro-
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CAS Number: 158641-49-7
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) | 2.20 | 1.19 | -6.27 | 2 | 2 | 0 | 40 | 156.156 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.20 | 2.07 | -44.05 | 1 | 2 | -1 | 43 | 155.148 | 1 | ↓ |