In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2004 | 25 | Yes |
Popular Name: 2-(butylthio)-5-tetralin-6-yl-1H-thieno[2,3-d]pyrimidin-4-one 2-(butylthio)-5-tetralin-6-yl-1H…
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) | 6.56 | 11.05 | -15.84 | 1 | 3 | 0 | 46 | 370.543 | 5 | ↓ |
Hi High (pH 8-9.5) | 7.02 | 9.81 | -47.84 | 0 | 3 | -1 | 49 | 369.535 | 5 | ↓ |