In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 11 | No |
Popular Name: Benzaldehyde, 4-fluoro-2,3-dihydroxy- Benzaldehyde, 4-fluoro-2,3-dihyd…
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CAS Number: 943126-88-3
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) | 1.31 | -0.57 | -8.63 | 2 | 3 | 0 | 58 | 156.112 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 0.36 | -34.42 | 1 | 3 | -1 | 60 | 155.104 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.31 | 0.35 | -41.9 | 1 | 3 | -1 | 60 | 155.104 | 1 | ↓ |