In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2008 | 30 | Yes |
Popular Name: 2-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-4,5-dimethoxy-benzoic 2-[[2-(1,3-dimethyl-2,6-dioxo-pu…
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) | 0.53 | 6.53 | -58.49 | 1 | 12 | -1 | 150 | 416.37 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.53 | 7.01 | -82.71 | 2 | 12 | 0 | 151 | 417.378 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.