In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 21 | Yes |
Popular Name: 2-[4-[2-(diethylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]-N-ethyl-acetamide 2-[4-[2-(diethylamino)-2-oxo-eth…
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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) | 0.59 | 4.47 | -42.71 | 2 | 6 | 1 | 57 | 299.439 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 6.48 | -117.84 | 3 | 6 | 2 | 58 | 300.447 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 4.47 | -43.23 | 2 | 6 | 1 | 57 | 299.439 | 7 | ↓ |