In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 25 | Yes |
Popular Name: N-[6-[4-(2-methoxyacetyl)-1,4-diazepan-1-yl]-3-pyridyl]-3-methyl-but-2-enamide N-[6-[4-(2-methoxyacetyl)-1,4-di…
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) | 1.63 | 7.64 | -16.06 | 1 | 7 | 0 | 75 | 346.431 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 7.92 | -44.39 | 2 | 7 | 1 | 76 | 347.439 | 5 | ↓ |