In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2010 | 27 | No |
Popular Name: 2-[butyl-[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]-2-oxo-ethyl]amino]acetamide 2-[butyl-[2-[(2R)-2-(4-methoxyph…
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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) | 2.92 | 7.91 | -43.3 | 3 | 6 | 1 | 77 | 376.521 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 5.97 | -15.74 | 2 | 6 | 0 | 76 | 375.513 | 9 | ↓ |