In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 27 | Yes |
Popular Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-dimethylaminophenyl)acetamide 2-(3-allyl-4-oxo-thieno[2,3-d]py…
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) | 3.28 | 8.8 | -14.69 | 1 | 6 | 0 | 67 | 400.529 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.28 | 9.55 | -90.91 | 2 | 6 | 0 | 68 | 401.537 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.