In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 20 | Yes |
Popular Name: ethyl 3-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)propanoate ethyl 3-(1,3-dimethyl-2,6-dioxo-…
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) | 0.26 | 1.93 | -13.45 | 0 | 8 | 0 | 88 | 280.284 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 2.19 | -52.51 | 1 | 8 | 1 | 89 | 281.292 | 5 | ↓ |