In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2004 | 27 | Yes |
Popular Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[[2-(azepan-1-yl)-2-keto-ethyl…
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) | 4.71 | -2.25 | -13.07 | 0 | 1 | 0 | 66 | 399.541 | 5 | ↓ |