In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 7th, 2010 | 25 | No |
Popular Name: (E)-3-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-2-cyano-N-(o-tolyl)prop-2-enamide (E)-3-(3-bromo-5-ethoxy-4-hydrox…
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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) | 4.27 | 7.42 | -10.71 | 2 | 5 | 0 | 82 | 401.26 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.27 | 8.34 | -44.73 | 1 | 5 | -1 | 85 | 400.252 | 5 | ↓ |