| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2010 | 24 | Yes |
Popular Name: 3,7-dimethyl-8-(4-thiazol-2-ylpiperazin-1-yl)purine-2,6-dione 3,7-dimethyl-8-(4-thiazol-2-ylpi…
| 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) | 0.12 | 6.88 | -11.01 | 1 | 9 | 0 | 92 | 347.404 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.12 | 7.32 | -38.81 | 2 | 9 | 1 | 93 | 348.412 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
