In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 25 | No |
Popular Name: N-isobutyl-2-[[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methylsulfanyl]acetamide N-isobutyl-2-[[4-oxo-5-(2-thieny…
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) | 3.08 | 7.54 | -20.83 | 2 | 5 | 0 | 75 | 393.559 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.54 | 6.43 | -51.75 | 1 | 5 | -1 | 78 | 392.551 | 7 | ↓ |