In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 28 | Yes |
Popular Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-[2-(8-quinolyl)ethyl]acetamide 2-(5,6-dimethylthieno[2,3-d]pyri…
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) | 3.48 | 9.59 | -15.68 | 1 | 5 | 0 | 68 | 408.552 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.48 | 9.96 | -41.41 | 2 | 5 | 1 | 69 | 409.56 | 6 | ↓ |