In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 2nd, 2008 | 31 | Yes |
Popular Name: 2-[3-benzyl-7-(2-methoxyethyl)-2,6-dioxo-purin-1-yl]-N-pentyl-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) | 2.69 | 10.84 | -18.34 | 1 | 9 | 0 | 100 | 427.505 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.69 | 11.35 | -56.07 | 2 | 9 | 1 | 101 | 428.513 | 11 | ↓ |