In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 2nd, 2008 | 29 | Yes |
Popular Name: 2-[3-benzyl-7-(2-methoxyethyl)-2,6-dioxo-purin-1-yl]-N-isopropyl-acetamide 2-[3-benzyl-7-(2-methoxyethyl)-2…
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) | 1.42 | 9.33 | -18.72 | 1 | 9 | 0 | 100 | 399.451 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.42 | 9.84 | -56.03 | 2 | 9 | 1 | 101 | 400.459 | 8 | ↓ |