In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 26 | Yes |
Popular Name: N-[[4-(ethylcarbamoyl)phenyl]methyl]-4-oxo-1H-quinoline-3-carboxamide N-[[4-(ethylcarbamoyl)phenyl]met…
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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) | 0.80 | 5.87 | -19.73 | 3 | 6 | 0 | 91 | 349.39 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.10 | 5.71 | -55.39 | 2 | 6 | -1 | 94 | 348.382 | 5 | ↓ |