In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2011 | 25 | No |
Popular Name: 2-ethoxy-6-[(E)-[2-(1,1,2,2-tetrafluoroethoxy)phenyl]iminomethyl]phenol 2-ethoxy-6-[(E)-[2-(1,1,2,2-tetr…
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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) | 4.60 | 5.95 | -9.01 | 1 | 4 | 0 | 51 | 357.303 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.60 | 7.99 | -54.66 | 0 | 4 | -1 | 54 | 356.295 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.60 | 6.86 | -43.79 | 0 | 4 | -1 | 54 | 356.295 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.60 | 7.52 | -9.7 | 2 | 4 | 0 | 53 | 358.311 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.60 | 6.38 | -36.28 | 2 | 4 | 1 | 53 | 358.311 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.